Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2222643

Cl.NCC(=O)c1cccc(Cl)c1

nearest known ligand 0.60

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 20)

geneUniProtsupporting neighboursconfidence
PARP1 known ✓ P09874 1/20 0.60
GRIN2B known ✓ Q13224 1/20 0.45
SLC6A2 known ✓ P23975 1/20 0.44
KCNK3 known ✓ O14649 1/20 0.44
KCNK9 known ✓ Q9NPC2 1/20 0.44
GAA known ✓ P10253 1/20 0.44
ERCC5 P28715 1/20 0.59
FEN1 P39748 1/20 0.59
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
IDO1 P14902 2/20 0.44
CXCR3 P49682 1/20 0.44
ALDH1A1 P00352 2/20 0.44
BLM P54132 1/20 0.44
PNMT P11086 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
P2RX7 Q99572 1/20 0.43

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
Hydrochloric Acid SCHEMBL30113107 1.00 PARP1 (0.60) PARP1ERCC5FEN1MEN1KMT2A
SCHEMBL71731 0.98 PARP1 (0.62) PARP1ERCC5FEN1MEN1KMT2A
SCHEMBL10792354 0.85 PARP1 (0.60) PARP1ERCC5FEN1MEN1KMT2A
Hydrochloric Acid SCHEMBL11784628 0.82 ERCC5 (0.61) PARP1ERCC5FEN1MEN1KMT2A
SCHEMBL11791699 0.82 ERCC5 (0.76) PARP1ERCC5FEN1MEN1KMT2A
SCHEMBL29962144 0.82 ERCC5 (0.76) PARP1ERCC5FEN1MEN1KMT2A
SCHEMBL10792681 0.80 PARP1 (0.55) PARP1ERCC5FEN1MEN1KMT2A
SCHEMBL97933 0.80 ERCC5 (0.62) PARP1ERCC5FEN1MEN1KMT2A
SCHEMBL4565219 0.80 ERCC5 (0.62) PARP1ERCC5FEN1MEN1KMT2A
SCHEMBL1712221 0.80 ERCC5 (0.62) PARP1ERCC5FEN1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023099561-A1 SUBSTITUTED N-CYANOPYRROLIDINES WITH ACTIVITY AS USP30 INHIBITORS MISSION THERAPEUTICS LIMITED (GB) 2023-06-08 WO disclosed
US-11034685-B2 Aminopyridine derivatives as TAM family kinase inhibitors SIGNALCHEM LIFESCIENCES CORPORATION (CA) 2021-06-15 US disclosed
US-11034686-B2 Aminopyridine derivatives as TAM family kinase inhibitors SIGNALCHEM LIFESCIENCES CORPORATION (CA) 2021-06-15 US disclosed
US-20200299287-A1 AMINOPYRIDINE DERIVATIVES AS TAM FAMILY KINASE INHIBITORS SIGNALCHEM LIFESCIENCES CORPORATION (CA) 2020-09-24 US disclosed
US-20200299288-A1 AMINOPYRIDINE DERIVATIVES AS TAM FAMILY KINASE INHIBITORS SIGNALCHEM LIFESCIENCES CORPORATION (CA) 2020-09-24 US disclosed
US-10723725-B2 Aminopyridine derivatives as TAM family kinase inhibitors SIGNALCHEM LIFESCIENCES CORPORATION (CA) 2020-07-28 US disclosed
EP-3074390-B1 AMINOPYRIDINE DERIVATIVES AS TAM FAMILY KINASE INHIBITORS SIGNALCHEM LIFESCIENCES CORP (CA) 2020-07-08 EP disclosed
US-20190152965-A1 AMINOPYRIDINE DERIVATIVES AS TAM FAMILY KINASE INHIBITORS SIGNALCHEM LIFESCIENCES CORPORATION (CA) 2019-05-23 US disclosed
US-10233176-B2 Aminopyridine derivatives as TAM family kinase inhibitors SIGNALCHEM LIFESCIENCES CORPORATION (CA) 2019-03-19 US disclosed
US-10035790-B2 RORγ modulators EXELIXIS, INC. (US) 2018-07-31 US disclosed
WO-2002015662-A2 QUINUCLIDINE-SUBSTITUTED HETEROARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS PHARMACIA & UPJOHN COMPANY (US) 2002-02-28 WO disclosed
WO-2002017358-A2 QUINUCLIDINE-SUBSTITUTED HETEROARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS) PHARMACIA & UPJOHN COMPANY (US) 2002-02-28 WO disclosed
US-6114582-A DECYCLIZATION TO FORM A CHEMICAL INTERMEDIATE FOR PRODUCING AN ANTI-OBESITY AGENT AND ANTIDIABETIC AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2000-09-05 US disclosed
EP-0939134-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-09-01 EP disclosed
EP-0924193-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-06-23 EP disclosed
EP-0924194-A2 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-06-23 EP disclosed
US-5811293-A CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-22 US disclosed
US-5608109-A AGRICULTURAL AND HORTICULTURAL INSECTICIDE NIHON NOHYAKU CO., LTD. (JP) 1997-03-04 US disclosed
EP-0657421-A1 Hydrazine derivatives and their use as insecticides NIHON NOHYAKU CO., LTD. (JP) 1995-06-14 EP disclosed
EP-0654534-A2 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1995-05-24 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-10035790-B2 RORγ modulators RORB, RORA, RORC PARP1 4784/4885GRIN2B 745/4885SLC6A2 4710/4885
US-20200299287-A1 AMINOPYRIDINE DERIVATIVES AS TAM FAMILY KINASE INHIBITORS MAP3K6, MAP3K5, MERTK PARP1 999/4885GRIN2B 1853/4885SLC6A2 3994/4885
US-10723725-B2 Aminopyridine derivatives as TAM family kinase inhibitors MAP3K6, MAP3K5, MERTK PARP1 999/4885GRIN2B 1853/4885SLC6A2 3994/4885
US-11034685-B2 Aminopyridine derivatives as TAM family kinase inhibitors MAP3K6, MAP3K5, MERTK PARP1 999/4885GRIN2B 1853/4885SLC6A2 3994/4885
US-11034686-B2 Aminopyridine derivatives as TAM family kinase inhibitors MAP3K6, MAP3K5, MERTK PARP1 999/4885GRIN2B 1853/4885SLC6A2 3994/4885
US-10233176-B2 Aminopyridine derivatives as TAM family kinase inhibitors MAP3K6, MAP3K5, MERTK PARP1 999/4885GRIN2B 1853/4885SLC6A2 3994/4885
US-20200299288-A1 AMINOPYRIDINE DERIVATIVES AS TAM FAMILY KINASE INHIBITORS MAP3K6, MAP3K5, MERTK PARP1 999/4885GRIN2B 1853/4885SLC6A2 3994/4885
US-20190152965-A1 AMINOPYRIDINE DERIVATIVES AS TAM FAMILY KINASE INHIBITORS MAP3K6, MAP3K5, MERTK PARP1 999/4885GRIN2B 1853/4885SLC6A2 3994/4885

“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.