SCHEMBL91132

SCHEMBL91132

CCCc1ccccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.60
SLC6A2 P23975 1/20 0.55
SLC6A4 P31645 1/20 0.55
SLC6A3 Q01959 1/20 0.55
AOC3 Q16853 1/20 0.55
IDO1 P14902 3/20 0.52
PNMT P11086 1/20 0.52
KCNH2 Q12809 1/20 0.50
HTR3E A5X5Y0 1/20 0.48
HTR3B O95264 1/20 0.48
HTR3A P46098 1/20 0.48
HTR3D Q70Z44 1/20 0.48
HTR3C Q8WXA8 1/20 0.48
PYCR1 P32322 1/20 0.47
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.44
PKM P14618 1/20 0.43
DAO P14920 1/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 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
Ammonia Solution, Strong SCHEMBL3789554 0.98 TAAR1 (0.58) TAAR1SLC6A2SLC6A4SLC6A3AOC3
Formaldehyde SCHEMBL27848039 0.93 TAAR1 (0.54) TAAR1SLC6A2SLC6A4SLC6A3AOC3
SCHEMBL256701 0.86 TAAR1 (0.56) TAAR1SLC6A2SLC6A4SLC6A3AOC3
Ammonia Solution, Strong SCHEMBL9427687 0.84 TAAR1 (0.54) TAAR1SLC6A2SLC6A4SLC6A3AOC3
SCHEMBL1374203 0.84 LIPG (0.55) TAAR1SLC6A2SLC6A4SLC6A3AOC3
SCHEMBL6740216 0.84 TAAR1 (0.71) TAAR1SLC6A2SLC6A4SLC6A3AOC3
SCHEMBL3694247 0.82 LIPG (0.58) TAAR1SLC6A2SLC6A4SLC6A3AOC3
SCHEMBL11658176 0.82 LIPG (0.58) TAAR1SLC6A2SLC6A4SLC6A3AOC3
SCHEMBL5598971 0.82 LIPG (0.58) TAAR1SLC6A2SLC6A4SLC6A3AOC3
SCHEMBL5271594 0.82 LIPG (0.58) TAAR1SLC6A2SLC6A4SLC6A3AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109633142-A A kind of method for building up of acute myelocytic leukemia diagnostic model and its application 中国人民解放军第四军医大学 2019-04-16 CN claimed
CN-109115933-A A method of screening Protective effects of Sini decoction myocardial ischemia effective substance 中国人民解放军第四军医大学 2019-01-01 CN claimed
CN-105461896-B A kind of bridge High Hardness Polyurethane Elastomer bearing material and preparation method thereof and application method 黎明化工研究设计院有限责任公司 2018-06-08 CN claimed
EP-1902034-A1 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESS FOR THEIR PREPARATION Glenmark Pharmaceuticals S.A. (CH) 2008-03-26 EP claimed
US-20060281961-A1 Functional transition metal silicates KANUMURU RAHUL RAJU (IN) 2006-12-14 US claimed
WO-2006129178-A1 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESS FOR THEIR PREPARATION GLENMARK PHARMACEUTICALS S.A. (US) 2006-12-07 WO claimed
WO-2006011000-A1 NOVEL C6-SUBSTITUTED FURANOID SUGAR AMINO ACIDS AND IMPROVED PROCESS FOR PREPARING THE SAME COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2006-02-02 WO claimed
US-20060014939-A1 Novel C6-substituted furanoid sugar amino acids and improved process for preparing the same COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH 2006-01-19 US claimed
CN-1234459-C Application method of solid acid catalyst CHINA PETROCHEMICAL CORP (CN) 2006-01-04 CN claimed
CN-1234460-C Regeneration process for solid acid catalyst CHINA PETROCHEMICAL CROP (CN) 2006-01-04 CN claimed
CN-1541768-A Application method of solid acid catalyst 中国石油化工股份有限公司 2004-11-03 CN claimed
CN-1520928-A Regeneration process for solid acid catalyst 中国石油化工股份有限公司 2004-08-18 CN claimed
US-4140695-A Process for producing copper phthalocyanines IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1979-02-20 US claimed
CN-117568296-A P450 hydroxylase mutant and synthetic R-halohydrin thereof 遵义医科大学 2024-02-20 CN disclosed
WO-2024030960-A2 COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS Kojin Therapeutics, Inc. (US) 2024-02-08 WO disclosed
US-20240016775-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR FUKANG (SHANGHAI) HEALTH TECHNOLOGY CO., LTD (CN) 2024-01-18 US disclosed
US-4076746-A FROM AN ALKYL OR ARYL HALIDE AND PHOSPHORUS SESQUISULFIDE STAUFFER CHEMICAL COMPANY (US) 1978-02-28 US disclosed
US-3968156-A Process for preparing alkyl-or arylphosphonothioic dihalides STAUFFER CHEMICAL COMPANY (US) 1976-07-06 US disclosed
US-3966830-A SILICA, ALUMINA TEIJIN LIMITED (JA) 1976-06-29 US disclosed
US-3931218-A HYPOGLYCEMIC ANTIRESERPINE, ANTIULCER, OGENIC, ANTIARRHYTHMIA AMERICAN HOME PRODUCTS CORPORATION (US) 1976-01-06 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 (2 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-20240016775-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR PARP3, PARP1, PARP4 TAAR1 4878/4885SLC6A2 4625/4885SLC6A4 2710/4885
US-20060014939-A1 Novel C6-substituted furanoid sugar amino acids and improved process for preparing the same HRH3, FFAR3, SSTR3 TAAR1 844/4885SLC6A2 3445/4885SLC6A4 3032/4885

“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.