Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9688286

CN1CCC2(CCNC2)C1.Cl.Cl

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.59
CYP2D6 P10635 7/20 0.39
CYP3A4 P08684 6/20 0.39
ALDH1A1 P00352 6/20 0.39
CYP1A2 P05177 4/20 0.39
HSD17B10 Q99714 4/20 0.39
USP2 O75604 5/20 0.37
SOS1 Q07889 1/20 0.35
SOS2 Q07890 1/20 0.35
CYP2C9 P11712 1/20 0.34
HPGD P15428 3/20 0.33
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL3 Q96JM7 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP11B1 P15538 1/20 0.32
KHK P50053 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12457837 0.98 TSHR (0.56) TSHRCYP2D6CYP3A4ALDH1A1CYP1A2
SCHEMBL13879323 0.98 TSHR (0.56) TSHRCYP2D6CYP3A4ALDH1A1CYP1A2
SCHEMBL2743300 0.98 TSHR (0.56) TSHRCYP2D6CYP3A4ALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL1298944 0.87 TSHR (0.44) TSHRCYP2D6CYP3A4ALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL27007071 0.87 TSHR (0.44) TSHRCYP2D6CYP3A4ALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL31189130 0.87 TSHR (0.53) TSHRCYP2D6CYP3A4ALDH1A1CYP1A2
SCHEMBL1753856 0.86 TSHR (0.49) TSHRCYP2D6CYP3A4ALDH1A1CYP1A2
SCHEMBL18632964 0.86 CYP3A4 (0.53) TSHRCYP2D6CYP3A4ALDH1A1CYP1A2
SCHEMBL255503 0.86 CYP3A4 (0.53) TSHRCYP2D6CYP3A4ALDH1A1CYP1A2
SCHEMBL1755476 0.85 TSHR (0.50) TSHRCYP2D6CYP3A4ALDH1A1CYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12257254-B2 Compositions comprising phosphoinositide 3-kinase inhibitors and a second antiproliferative agent CONVALIFE (SHANGHAI) CO. LIMITED (CN) 2025-03-25 US disclosed
US-11779586-B2 Compounds comprising tricyclic heterocyclic compounds CONVALIFE (SHANGHAI) CO. LIMITED (CN) 2023-10-10 US disclosed
US-11708378-B2 Tricyclic heterocyclic compounds as phosphoinositide 3-kinase inhibitors CONVALIFE (SHANGHAI) CO. LIMITED (CN) 2023-07-25 US disclosed
US-20230066999-A1 COMPOSITIONS COMPRISING PHOSPHOINOSITIDE 3-KINASE INHIBITORS AND A SECOND ANTIPROLIFERATIVE AGENT KARUS THERAPEUTICS LIMITED (GB) 2023-03-02 US disclosed
EP-3337460-B1 COMPOSITIONS COMPRISING TRICYCLIC HETEROCYCLIC COMPOUNDS CONVALIFE SHANGHAI CO LTD (CN) 2023-02-15 EP disclosed
EP-3337477-B1 COMPOSITIONS COMPRISING PHOSPHOINOSITIDE 3-KINASE INHIBITORS AND A SECOND ANTIPROLIFERATIVE AGENT CONVALIFE SHANGHAI CO LTD (CN) 2023-02-01 EP disclosed
US-11291669-B2 Compositions comprising phosphoinositide 3-kinase inhibitors and a second antiproliferative agent KARUS THERAPEUTICS LIMITED (GB) 2022-04-05 US disclosed
US-20210275537-A1 COMPOUNDS COMPRISING TRICYCLIC HETEROCYCLIC COMPOUNDS CONVALIFE (SHANGHAI) CO. LIMITED (CN) 2021-09-09 US disclosed
US-20210069200-A1 COMPOSITIONS COMPRISING PHOSPHOINOSITIDE 3-KINASE INHIBITORS AND A SECOND ANTIPROLIFERATIVE AGENT CONVALIFE (SHANGHAI) CO. LIMITED (CN) 2021-03-11 US disclosed
US-20200354378-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS AS PHOSPHOINOSITIDE 3-KINASE INHIBITORS KARUS THERAPEUTICS LTD (GB) 2020-11-12 US disclosed
US-4665079-A QUINOLINE DERIVATIVES WARNER-LAMBERT COMPANY (US) 1987-05-12 US disclosed
US-4638067-A NAPHTHYRIDINE AND QUINOLINE CARBOXYLIC ACIDS WARNER-LAMBERT CO. (US) 1987-01-20 US disclosed
US-4604401-A QUINOLINE-CARBOXYLIC ACIDS WARNER-LAMBERT COMPANY (US) 1986-08-05 US disclosed
EP-0174077-A1 -9-fluoro-6,7-dihydro-5-methyl-1-oxo-8-substituted-1H,5H, benzo(ij)-quinoziline-2-carboxylic acids; their derivatives; and processes for producing the compounds WARNER-LAMBERT COMPANY (US) 1986-03-12 EP disclosed
EP-0172651-A1 Substituted-9-fluoro-3-methyl-7-oxo-2,3-dihydro-7H-pyrido[1,2,3-de][1,4]benzoxazine-6-carboxylic acids; substituted-5-amino-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acids; substituted-5-amino-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acids; derivatives thereof; pharmaceutical compositions comprising the compounds; and processes for producing the compounds WARNER-LAMBERT COMPANY (US) 1986-02-26 EP disclosed
EP-0169710-A2 7-Substituted-6-fluoro-8-substituted-1,4-dihydro-1-methylamino-4-oxo-3-quinolinecarboxylic acids; 7-substituted-6-fluoro-1,4-dihydro-1-methylamino-4-oxo-3-naphthyridine carboxylic acids; derivatives thereof; and processes for producing the compounds WARNER-LAMBERT COMPANY (US) 1986-01-29 EP disclosed
US-4550103-A Antibacterial 1-oxo-benzoquinolizine-2-carboxylic acids WARNER-LAMBERT COMPANY (US) 1985-10-29 US disclosed
US-4550104-A Antibacterial thiazolo-quinolines and thiazolo-naphthyridines WARNER-LAMBERT COMPANY (US) 1985-10-29 US disclosed
EP-0153163-A2 7-Substituted-1-cyclopropyl-6,8-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acids; 7-substituted-1-cyclopropyl-1,4-dihydro-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acids; their derivatives; and a process for preparing the compounds WARNER-LAMBERT COMPANY (US) 1985-08-28 EP disclosed
EP-0106489-A2 Antibacterial agents WARNER-LAMBERT COMPANY (US) 1984-04-25 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11708378-B2 Tricyclic heterocyclic compounds as phosphoinositide 3-kinase inhibitors PIK3CA, PIK3C2A, PIK3C2B TSHR 1886/4885CYP2D6 2935/4885CYP3A4 2888/4885
US-11291669-B2 Compositions comprising phosphoinositide 3-kinase inhibitors and a second antiproliferative agent MCL1, MYC, XIAP TSHR 3938/4885CYP2D6 3392/4885CYP3A4 4193/4885
US-20200354378-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS AS PHOSPHOINOSITIDE 3-KINASE INHIBITORS PIK3CA, PIK3C2A, PIK3C2B TSHR 1886/4885CYP2D6 2935/4885CYP3A4 2888/4885
US-12257254-B2 Compositions comprising phosphoinositide 3-kinase inhibitors and a second antiproliferative agent MCL1, MYC, XIAP TSHR 3938/4885CYP2D6 3392/4885CYP3A4 4193/4885
US-20210069200-A1 COMPOSITIONS COMPRISING PHOSPHOINOSITIDE 3-KINASE INHIBITORS AND A SECOND ANTIPROLIFERATIVE AGENT MCL1, MYC, XIAP TSHR 3938/4885CYP2D6 3392/4885CYP3A4 4193/4885
US-11779586-B2 Compounds comprising tricyclic heterocyclic compounds GRN, GLA, HTT TSHR 2157/4885CYP2D6 1878/4885CYP3A4 884/4885
US-20230066999-A1 COMPOSITIONS COMPRISING PHOSPHOINOSITIDE 3-KINASE INHIBITORS AND A SECOND ANTIPROLIFERATIVE AGENT MCL1, MYC, XIAP TSHR 3938/4885CYP2D6 3392/4885CYP3A4 4193/4885
US-20210275537-A1 COMPOUNDS COMPRISING TRICYCLIC HETEROCYCLIC COMPOUNDS GRN, GLA, HTT TSHR 2157/4885CYP2D6 1878/4885CYP3A4 884/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.