Hydrochloric Acid

Hydrochloric Acid

SCHEMBL66010

CCCCCCCCCCCCc1ccc(C[N+](C)(C)C)cc1.[Cl-]

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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
SLC6A2 known ✓ P23975 2/20 0.57
SLC6A3 known ✓ Q01959 2/20 0.57
CHRM2 known ✓ P08172 1/20 0.57
CHRM1 known ✓ P11229 1/20 0.57
CHRM3 known ✓ P20309 1/20 0.57
ACHE known ✓ P22303 1/20 0.57
ESR1 P03372 2/20 0.57
ADRA2A P08913 2/20 0.57
ADORA3 P0DMS8 2/20 0.57
TACR2 P21452 2/20 0.57
SLC6A4 P31645 2/20 0.57
TP53 P04637 2/20 0.57
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 2/20 0.57
HSD17B10 Q99714 2/20 0.57
LMNA P02545 1/20 0.57
SHBG P04278 1/20 0.57
CYP3A4 P08684 1/20 0.57
HSPD1 P10809 1/20 0.57
ADRB3 P13945 1/20 0.57

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
SCHEMBL12114083 0.98 ESR1 (0.59) ESR1ADRA2AADORA3TACR2SLC6A2
Water SCHEMBL9717479 0.96 ESR1 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
Hydrochloric Acid SCHEMBL4981893 0.83 HSP90AA1 (0.73) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL2511615 0.82 ESR1 (0.77) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL6681490 0.82 ESR1 (0.77) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL23849704 0.82 ESR1 (0.77) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL6684861 0.82 ESR1 (0.77) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL4037557 0.82 ESR1 (0.77) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL10571467 0.82 ESR1 (0.77) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL10758361 0.82 ESR1 (0.77) ESR1ADRA2AADORA3TACR2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3675855-B1 ISOQUINOLINES AND 1H-2-BENZOPYRANES FOR USE IN THE TREATMENT OF EPILEPSY UNIV LEUVEN KATH (BE) 2024-08-28 EP claimed
US-11826364-B2 Treatment for epilepsy KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-28 US claimed
US-20230108004-A1 TREATMENT OF EPILEPSY WITH PLINABULIN OR HALIMIDE OR DIKETOPIPERAZINE DERIVATIVES UNIV LEUVEN KATH (BE) 2023-04-06 US claimed
CN-115739124-A Novel cadmium sulfide nanosphere photocatalyst and preparation method thereof 电子科技大学长三角研究院(湖州) 2023-03-07 CN claimed
CN-115722217-A Novel tungsten oxide nanorod photocatalyst and preparation method thereof 电子科技大学长三角研究院(湖州) 2023-03-03 CN claimed
CN-115701972-A Compositions comprising zinc and an antimicrobial agent 联合利华知识产权控股有限公司 2023-02-14 CN claimed
CN-111093775-B Method for controlling staining of teeth by cationic antimicrobial agents 联合利华知识产权控股有限公司 2022-11-08 CN claimed
CN-114989044-A Catalytic synthesis method of dicarbamate 中国科学院过程工程研究所 2022-09-02 CN claimed
US-20220265638-A1 TREATMENT FOR EPILEPSY TECHNICAL UNIVERSITY OF DENMARK (DK) 2022-08-25 US claimed
CN-112515987-A Oral care compositions with adducts of clay and antibacterial agent 荷兰联合利华有限公司 2021-03-19 CN claimed
US-20050025833-A1 Pharmaceutical composition and method for transdermal drug delivery PERRIGO ISRAEL PHARMACEUTICALS LTD. (IL) 2005-02-03 US claimed
EP-1336602-A1 Nitrate prodrugs able to release nitric oxide in a controlled and selective way and their use for prevention and treatment of inflammatory, ischemic and proliferative diseases Scaramuzzino, Giovanni (IT) 2003-08-20 EP claimed
US-20030091620-A1 Transdermal drug delivery systems containing quaternary ammonium salts and methods of using the same FIKSTAD DAVID (US) 2003-05-15 US claimed
EP-1066280-A4 HALIMIDE, A CYTOTOXIC MARINE NATURAL PRODUCT, AND DERIVATIVES THEREOF UNIV CALIFORNIA (US) 2003-02-26 EP claimed
EP-1217975-A1 USING QUATERNARY AMMONIUM SALTS FOR TRANSDERMAL DRUG DELIVERY Watson Pharmaceuticals, Inc. (US) 2002-07-03 EP claimed
WO-2001017472-A1 USING QUATERNARY AMMONIUM SALTS FOR TRANSDERMAL DRUG DELIVERY WATSON PHARMACEUTICALS, INC. (US) 2001-03-15 WO claimed
EP-1066280-A1 HALIMIDE, A CYTOTOXIC MARINE NATURAL PRODUCT, AND DERIVATIVES THEREOF The Regents of the University of California (US) 2001-01-10 EP claimed
US-6069146-A Halimide, a cytotoxic marine natural product, and derivatives thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-05-30 US claimed
WO-1999048889-A1 HALIMIDE, A CYTOTOXIC MARINE NATURAL PRODUCT, AND DERIVATIVES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-09-30 WO claimed
US-3992432-A Phase transfer catalysis of heterogeneous reactions by quaternary salts CONTINENTAL OIL COMPANY (US) 1976-11-16 US claimed

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

For each of this compound's patents that has machine-readable text (3 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-11826364-B2 Treatment for epilepsy GABARAPL2, HDAC2, GABRB2 SLC6A2 1117/4885SLC6A3 2074/4885CHRM2 1135/4885
US-20030091620-A1 Transdermal drug delivery systems containing quaternary ammonium salts and methods of using the same SLC38A7, SUCNR1, SLC7A1 SLC6A2 46/4885SLC6A3 311/4885CHRM2 1566/4885
US-20220265638-A1 TREATMENT FOR EPILEPSY GABARAPL2, GABRB2, CNR2 SLC6A2 911/4885SLC6A3 1958/4885CHRM2 754/4885

“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.