Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4372170

Cl.NNc1ccc(Oc2ccc(F)cc2)cc1

nearest known ligand 0.47

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
SCN9A known ✓ Q15858 3/20 0.46
KCNH2 known ✓ Q12809 2/20 0.46
SCN5A known ✓ Q14524 2/20 0.46
CA2 known ✓ P00918 1/20 0.42
SCN4A known ✓ P35499 2/20 0.40
MAOA known ✓ P21397 1/20 0.39
MAOB known ✓ P27338 1/20 0.39
S1PR2 known ✓ O95136 1/20 0.38
CACNA1B known ✓ Q00975 1/20 0.38
SOS1 Q07889 1/20 0.47
FFAR1 O14842 1/20 0.45
FFAR4 Q5NUL3 1/20 0.45
TTBK1 Q5TCY1 1/20 0.43
TTBK2 Q6IQ55 1/20 0.43
HSPB1 P04792 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
F2 P00734 1/20 0.41
PLG P00747 1/20 0.41

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
SCHEMBL4371426 0.98 SOS1 (0.48) SOS1SCN9AKCNH2SCN5AFFAR1
Hydrochloric Acid SCHEMBL5925413 0.89 ALDH1A1 (0.48) CA12CA1CA2CA9F2
Hydrochloric Acid SCHEMBL303900 0.86 IDO1 (0.48) CA12CA1CA2CA9ALDH1A1
SCHEMBL4847705 0.86 ALDH1A1 (0.50) CA12CA1CA2CA9F2
SCHEMBL8250 0.83
Hydrochloric Acid SCHEMBL25275189 0.83 CDK8 (0.46) SOS1FFAR1FFAR4CA12CA1
Hydrochloric Acid SCHEMBL31229387 0.83 CDK8 (0.46) SOS1FFAR1FFAR4CA12CA1
Hydrochloric Acid SCHEMBL4373592 0.81 PGR (0.49) SCN9AKCNH2FFAR1FFAR4CA12
Bromide SCHEMBL20984751 0.81 IDO1 (0.48) CA12CA1CA2CA9ALDH1A1
Water SCHEMBL9206581 0.81 IDO1 (0.48) CA12CA1CA2CA9ALDH1A1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119707816-A Pyrazole hydrazide derivative containing diphenyl ether unit as well as preparation method and application thereof 江苏海洋大学 2025-03-28 CN disclosed
US-20230391790-A1 INDENE DERIVATIVES USEFUL IN TREATING PAIN AND INFLAMMATION TARO PHARMACEUTICALS INC. (CA) 2023-12-07 US disclosed
US-11773108-B2 Indene derivatives useful in treating pain and inflammation TARO PHARMACEUTICALS INC. (CA) 2023-10-03 US disclosed
US-20220306645-A1 INDENE DERIVATIVES USEFUL IN TREATING PAIN AND INFLAMMATION TARO PHARMACEUTICALS INC. (CA) 2022-09-29 US disclosed
US-11352367-B2 Indene derivatives useful in treating pain and inflammation TARO PHARMACEUTICALS INC. (CA) 2022-06-07 US disclosed
CN-112543753-A Indene derivatives useful for treating pain and inflammation 塔罗制药公司 2021-03-23 CN disclosed
EP-3774738-A1 INDENE DERIVATIVES USEFUL IN TREATING PAIN AND INFLAMMATION Aquinox Pharmaceuticals (Canada) Inc. (CA) 2021-02-17 EP disclosed
US-20210032264-A1 INDENE DERIVATIVES USEFUL IN TREATING PAIN AND INFLAMMATION AQUINOX PHARMACEUTICALS (CANADA) INC. (CA) 2021-02-04 US disclosed
WO-2019195777-A1 INDENE DERIVATIVES USEFUL IN TREATING PAIN AND INFLAMMATION AQUINOX PHARMACEUTICALS (CANADA) INC. (CA) 2019-10-10 WO disclosed
EP-1292577-B1 ARYL SUBSTITUTED PYRAZOLES, TRIAZOLES AND TETRAZOLES AS SODIUM CHANNEL BLOCKER EURO CELTIQUE SA (LU) 2012-10-24 EP disclosed
WO-2009117421-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-09-24 WO disclosed
US-7078426-B2 Aryl substituted pyrazoles, triazoles, and tetrazoles, and the use thereof EURO-CELTIQUE S.A. (LU) 2006-07-18 US disclosed
US-6919363-B2 Aryl substituted pyrazoles, triazoles and tetrazoles, and the use thereof EURO-CELTIQUE S.A. (LU) 2005-07-19 US disclosed
US-20040002523-A1 Aryl substituted pyrazoles, triazoles and tetrazoles, and the use thereof EURO-CELTIQUE S.A. 2004-01-01 US disclosed
US-20020006947-A1 Aryl substituted pyrazoles, triazoles, and tetrazoles, and the use thereof PURDUE PHARMA L.P. 2002-01-17 US 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 (7 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-20230391790-A1 INDENE DERIVATIVES USEFUL IN TREATING PAIN AND INFLAMMATION IL1B, IL1A, LTB4R SCN9A 1020/4885KCNH2 1434/4885SCN5A 1611/4885
US-20210032264-A1 INDENE DERIVATIVES USEFUL IN TREATING PAIN AND INFLAMMATION IL1B, IL1A, LTB4R SCN9A 1020/4885KCNH2 1434/4885SCN5A 1611/4885
US-20220306645-A1 INDENE DERIVATIVES USEFUL IN TREATING PAIN AND INFLAMMATION IL1B, IL1A, LTB4R SCN9A 985/4885KCNH2 1399/4885SCN5A 1629/4885
US-11352367-B2 Indene derivatives useful in treating pain and inflammation IL1B, IL1A, LTB4R SCN9A 1020/4885KCNH2 1434/4885SCN5A 1611/4885
US-11773108-B2 Indene derivatives useful in treating pain and inflammation IL1B, IL1A, LTB4R SCN9A 985/4885KCNH2 1399/4885SCN5A 1629/4885
US-20040002523-A1 Aryl substituted pyrazoles, triazoles and tetrazoles, and the use thereof CACNA1I, GRIK5, SOD1 SCN9A 318/4885KCNH2 285/4885SCN5A 10/4885
US-20020006947-A1 Aryl substituted pyrazoles, triazoles, and tetrazoles, and the use thereof GRIK5, CACNA1I, SOD1 SCN9A 349/4885KCNH2 363/4885SCN5A 11/4885

“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.