SCHEMBL546183

SCHEMBL546183

COc1ccc(C#N)cc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.50
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 3/20 0.49
HPGD P15428 2/20 0.49
LCK P06239 1/20 0.47
FYN P06241 1/20 0.47
SLC22A12 Q96S37 1/20 0.45
MAPT P10636 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
APP P05067 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA7 P43166 1/20 0.44
TPMT P51580 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
KMT2A Q03164 1/20 0.44

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 SCHEMBL10984138 0.98 AR (0.49) ARALDH1A1KDM4EHPGDLCK
SCHEMBL3996717 0.87 CFD (0.51) ARALDH1A1KDM4EHPGDLCK
SCHEMBL1614434 0.86 ALDH1A1 (0.57) ARALDH1A1KDM4EHPGDLCK
SCHEMBL20855586 0.86 AR (0.50) ARALDH1A1KDM4EMAPTCA9
SCHEMBL30468153 0.86 AR (0.50) ARALDH1A1KDM4EMAPTCA9
SCHEMBL29546482 0.85 AR (0.49) ARALDH1A1KDM4EHPGDMAPT
SCHEMBL477893 0.85 AR (0.49) ARALDH1A1MAPTKMT2AMRGPRX4
SCHEMBL385459 0.85 AR (0.49) ARALDH1A1KDM4EHPGDMAPT
SCHEMBL26388273 0.84 GSK3B (0.50) ARALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL16955916 0.82 AR (0.53) ARALDH1A1KDM4EMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12492166-B2 Sulfonylurea derivative and medical uses thereof SHANGHAI SENHUI MEDICINE CO., LTD (CN) 2025-12-09 US disclosed
CN-120004770-A Sulfonylurea derivative and medical application thereof 上海森辉医药有限公司 2025-05-16 CN disclosed
CN-115836050-B Sulfonylurea derivative and medical application thereof 上海森辉医药有限公司 2024-12-20 CN disclosed
US-20230348371-A1 SULFONYLUREA DERIVATIVE AND MEDICAL USES THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2023-11-02 US disclosed
US-20230348371-A1 SULFONYLUREA DERIVATIVE AND MEDICAL USES THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2023-11-02 US disclosed
US-20230348371-A1 SULFONYLUREA DERIVATIVE AND MEDICAL USES THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2023-11-02 US disclosed
CN-116444404-A Salt of sulfonylurea derivative and crystal form thereof 江苏恒瑞医药股份有限公司 2023-07-18 CN disclosed
CN-116444403-A Crystal form of sulfonylurea derivative 江苏恒瑞医药股份有限公司 2023-07-18 CN disclosed
WO-2023098876-A1 CARBONYL SUBSTITUTED DIAZASPIRO COMPOUNDS AND ITS USE BIONOVA PHARMACEUTICALS (SHANGHAI) LIMITED (CN) 2023-06-08 WO disclosed
EP-4183774-A1 SULFONYLUREA DERIVATIVE AND MEDICAL USES THEREOF Shanghai Senhui Medicine Co., Ltd. (CN) 2023-05-24 EP disclosed
WO-2002068417-A2 HETEROPOLYCYCLIC COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS NPS PHARMACEUTICALS, INC. (US) 2002-09-06 WO disclosed
EP-0874843-B1 SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL) 1,4]DIAZEPANES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES AVENTIS PHARMA INC (US) 2002-08-07 EP disclosed
US-6423704-B2 CROHN'S DISEAS, ANTIULCER AGENTS, ASTHMA, EMESIS AVENTIS PHARMACEUTICALS INC. 2002-07-23 US disclosed
US-20010034343-A1 Novel substituted 4-(1H-benzimidazol-2-yl) [1,4]diazepanes useful for the treatment of allergic diseases AVENTIS PHARMACEUTICALS INC. 2001-10-25 US disclosed
US-6211199-B1 HISTAMINE AND TACHYKININ RECEPTOR ANTAGONISTS; ANTIASTHMATICS, ANTIEMETICS; RESPIRATORY SYSTEM DISORDERS, INFLAMMATORY BOWEL DISEASE, CONJUNCTIVITIS AVENTIS PHARMACEUTICALS INC. 2001-04-03 US disclosed
US-6194406-B1 HISTAMINE RECEPTOR ANTAGONISTS; TACHYKININ RECEPTOR ANTAGONISTS; ASTHMA; BRONCHITIS; INFLAMMATORY BOWEL DISEASES, INCLUDING CROHN'S DISEASE AND ULCERATIVE COLITIS; SEASONAL RHINITIS; SINUSITIS; ANTIALLERGENS; EMETIC AGENTS AVENTIS PHARMACEUTICALS INC. 2001-02-27 US disclosed
EP-0920425-A1 SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL-AMINO)PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1999-06-09 EP disclosed
EP-0874843-A1 NOVEL SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL) 1,4]DIAZEPANES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1998-11-04 EP disclosed
WO-1997022604-A1 NOVEL SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL)[1,4]DIAZEPANES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1997-06-26 WO disclosed
WO-1997019074-A1 SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL-AMINO)PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1997-05-29 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 (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-20010034343-A1 Novel substituted 4-(1H-benzimidazol-2-yl) [1,4]diazepanes useful for the treatment of allergic diseases HRH4, HRH2, HRH1 AR 1523/4885ALDH1A1 953/4885KDM4E 1512/4885
US-12492166-B2 Sulfonylurea derivative and medical uses thereof PYGB, ATP6V1B2, GLP1R AR 4744/4885ALDH1A1 802/4885KDM4E 2974/4885
US-20230348371-A1 SULFONYLUREA DERIVATIVE AND MEDICAL USES THEREOF PYGB, ATP6V1B2, GLP1R AR 4744/4885ALDH1A1 802/4885KDM4E 2974/4885

“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.