Hydrochloric Acid

Hydrochloric Acid

SCHEMBL21609283

C=CC(N)(C=C)C(=O)O.Cl

nearest known ligand 0.35

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 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
FGFR4 P22455 1/20 0.33
CYP2C19 P33261 1/20 0.30

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
SCHEMBL13083468 0.97
SCHEMBL11536905 0.78 LMNA (0.33) LMNA
SCHEMBL11237630 0.76 GABRR1 (0.44) LMNATSHR
SCHEMBL11228740 0.76 GABRR1 (0.44) LMNATSHR
SCHEMBL7478604 0.73
SCHEMBL11235832 0.73 GABRR1 (0.32) LMNATSHR
SCHEMBL8935122 0.73 LMNA (0.37) LMNAALDH1A1TSHRFGFR4CYP2C19
SCHEMBL11235847 0.73 GABRR1 (0.32) LMNATSHR
Hydrochloric Acid SCHEMBL5166065 0.72
Hydrochloric Acid SCHEMBL5166075 0.72

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
US-12617768-B2 Radiolabeled cannabinoid receptor 2 ligand HOFFMANN-LA ROCHE INC. (US) 2026-05-05 US disclosed
EP-3813888-B1 RADIOLABELED CANNABINOID RECEPTOR 2 LIGAND HOFFMANN LA ROCHE (CH) 2025-11-26 EP disclosed
EP-3814337-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS PREFERENTIAL CANNABINOID 2 AGONISTS HOFFMANN LA ROCHE (CH) 2025-05-14 EP disclosed
US-20240308974-A1 RADIOLABELED CANNABINOID RECEPTOR 2 LIGAND HOFFMANN LA ROCHE (US) 2024-09-19 US disclosed
US-11999710-B2 Radiolabeled cannabinoid receptor 2 ligand HOFFMANN-LA ROCHE INC. (US) 2024-06-04 US disclosed
US-11655243-B2 Pyridine and pyrazine derivatives as preferential cannabinoid 2 agonists HOFFMANN-LA ROCHE INC. (US) 2023-05-23 US disclosed
EP-3995155-A1 RADIOLABELED CANNABINOID RECEPTOR 2 LIGAND F. Hoffmann-La Roche AG (CH) 2022-05-11 EP disclosed
EP-3814337-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS PREFERENTIAL CANNABINOID 2 AGONISTS F. Hoffmann-La Roche AG (CH) 2021-05-05 EP disclosed
EP-3813888-A1 RADIOLABELED CANNABINOID RECEPTOR 2 LIGAND F. Hoffmann-La Roche AG (CH) 2021-05-05 EP disclosed
US-20210115027-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS PREFERENTIAL CANNABINOID 2 AGONISTS HOFFMANN-LA ROCHE INC. (US) 2021-04-22 US disclosed
US-20210115012-A1 RADIOLABELED CANNABINOID RECEPTOR 2 LIGAND HOFFMANN-LA ROCHE INC. (US) 2021-04-22 US disclosed
CN-112638430-A Radiolabeled cannabinoid receptor 2 ligands 豪夫迈·罗氏有限公司 2021-04-09 CN disclosed
CN-112074513-A Pyridine and pyrazine derivatives as preferential cannabinoid 2 agonists 豪夫迈·罗氏有限公司 2020-12-11 CN disclosed
WO-2020002314-A1 RADIOLABELED CANNABINOID RECEPTOR 2 LIGAND F. HOFFMANN-LA ROCHE AG (CH) 2020-01-02 WO disclosed
WO-2020002270-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS PREFERENTIAL CANNABINOID 2 AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2020-01-02 WO 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 (6 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-20210115027-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS PREFERENTIAL CANNABINOID 2 AGONISTS CNR2, CNR1, TBXA2R LMNA 4237/4885ALDH1A1 1342/4885TSHR 348/4885
US-20240308974-A1 RADIOLABELED CANNABINOID RECEPTOR 2 LIGAND CNR1, CNR2, GPR18 LMNA 4449/4885ALDH1A1 1913/4885TSHR 179/4885
US-20210115012-A1 RADIOLABELED CANNABINOID RECEPTOR 2 LIGAND CNR1, CNR2, GPR18 LMNA 4449/4885ALDH1A1 1913/4885TSHR 179/4885
US-12617768-B2 Radiolabeled cannabinoid receptor 2 ligand CNR1, CNR2, GPR3 LMNA 4456/4885ALDH1A1 4013/4885TSHR 40/4885
US-11655243-B2 Pyridine and pyrazine derivatives as preferential cannabinoid 2 agonists CNR2, CNR1, TBXA2R LMNA 4237/4885ALDH1A1 1342/4885TSHR 348/4885
US-11999710-B2 Radiolabeled cannabinoid receptor 2 ligand CNR1, CNR2, GPR18 LMNA 4449/4885ALDH1A1 1913/4885TSHR 179/4885

“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.