SCHEMBL4444401

SCHEMBL4444401

OCCCCc1ccncc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.59
LOXL2 Q9Y4K0 2/20 0.50
NAAA Q02083 1/20 0.48
CA2 P00918 2/20 0.47
HRH3 Q9Y5N1 2/20 0.46
HRH4 Q9H3N8 1/20 0.46
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
CYP1A2 P05177 4/20 0.41
CYP3A4 P08684 4/20 0.41
CYP2D6 P10635 4/20 0.41
CYP2C9 P11712 4/20 0.41
CYP2C19 P33261 4/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPK14 Q16539 1/20 0.41
HIF1A Q16665 1/20 0.39

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
SCHEMBL271114 0.98 HRH1 (0.63) HRH1LOXL2NAAACA2HRH3
SCHEMBL5540660 0.98 HRH1 (0.63) HRH1LOXL2NAAACA2HRH3
Hydrochloric Acid SCHEMBL28059639 0.98 HRH1 (0.57) HRH1LOXL2NAAACA2HRH3
Hydrochloric Acid SCHEMBL7424038 0.96 HRH1 (0.61) HRH1LOXL2NAAACA2HRH3
SCHEMBL279761 0.93 HRH1 (0.56) HRH1LOXL2NAAACA2HRH3
SCHEMBL26116262 0.91 HRH1 (0.54) HRH1LOXL2NAAACA2HRH3
SCHEMBL726645 0.87 HRH1 (0.73) HRH1LOXL2NAAAHRH3HRH4
SCHEMBL2841394 0.85 HRH1 (0.77) HRH1LOXL2NAAAHRH3HRH4
SCHEMBL4413800 0.85 HRH1 (0.77) HRH1LOXL2NAAAHRH3HRH4
SCHEMBL725306 0.85 HRH1 (0.77) HRH1LOXL2NAAAHRH3HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117682983-A Pyridinium cationic compound, pyridinium cationic polymer, and preparation methods and application thereof 广州航海学院 2024-03-12 CN claimed
CN-112724757-A Ionomer coating for eliminating surface charge, preparation method thereof and corresponding coating 徐宁 2021-04-30 CN claimed
CN-106159327-B Lithium ion secondary battery 恺时浦(上海)检测技术有限公司 2019-08-30 CN claimed
CN-101898998-B Method for preparing tirofiban hydrochloride intermediate WUHAN WUYAO PHARMACEUTICAL CO LTD 2012-09-19 CN claimed
CN-101898998-A Method for preparing tirofiban hydrochloride intermediate WUHAN WUYAO PHARMACEUTICAL CO LTD 2010-12-01 CN claimed
CN-122011867-A Ionomer coatings for eliminating surface charge, method for preparing same and corresponding coatings 徐宁 2026-05-12 CN disclosed
CN-119907792-A Benzyl or thiophene methylene substituted aminoquinazoline derivatives and their use as SOS1 degradants 领泰生物医药(绍兴)有限公司 2025-04-29 CN disclosed
EP-4063675-B1 MEMBER FOR ELECTROPHOTOGRAPHY, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC IMAGE FORMING APPARATUS CANON KK (JP) 2025-01-22 EP disclosed
WO-2024111620-A1 POLYMER ELECTROLYTE, ELECTRODE ACTIVE MATERIAL BINDER, AND SECONDARY BATTERY キヤノン株式会社 2024-05-30 WO disclosed
CN-117682983-A Pyridinium cationic compound, pyridinium cationic polymer, and preparation methods and application thereof 广州航海学院 2024-03-12 CN disclosed
CN-114730149-B Electrophotographic member, process cartridge, and electrophotographic image forming apparatus 佳能株式会社 2024-01-26 CN disclosed
CN-117092226-A Tirofiban detection and quality control method 武汉武药科技有限公司 2023-11-21 CN disclosed
US-5312923-A Heterocyclic carboxysulfonamides MERCK & CO., INC. (US) 1994-05-17 US disclosed
US-5270322-A Imidazo[1,2-a]pyridines, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1993-12-14 US disclosed
CN-1076442-A The method for preparing fibrinogen deceptor antagonists MERCK & CO INC (US) 1993-09-22 CN disclosed
WO-1993016994-A1 PROCESS FOR THE PREPARATION OF 0-[4-(4-PIPERIDINYL)BUTYL]-TYROSINE DERIVATIVES AS FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1993-09-02 WO disclosed
US-5187280-A Dopaminergic, antipsychotic and antihypertensive agents WARNER-LAMBERT COMPANY (US) 1993-02-16 US disclosed
EP-0512352-A2 Substituted carboxylic acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1992-11-11 EP disclosed
US-5118691-A Substituted tetrahydropyridines as central nervous system agents WARNER-LAMBERT CO. (US) 1992-06-02 US disclosed
US-5045550-A Antipsychotic, hypotensive agents, dopaminergic WARNER-LAMBERT CO. (US) 1991-09-03 US disclosed