SCHEMBL516394

SCHEMBL516394

CN(C)c1cccs1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Piperazine SCHEMBL27854594 0.87 NISCH (0.35)
SCHEMBL26099756 0.83 FBP1 (0.36)
SCHEMBL15352282 0.79
SCHEMBL1627366 0.79
SCHEMBL1479801 0.77 FBP1 (0.39)
SCHEMBL28289230 0.75 HSD17B10 (0.35)
SCHEMBL8544254 0.75
SCHEMBL209430 0.74
SCHEMBL2779567 0.74 NPC1 (0.38)
SCHEMBL209431 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10224485-B2 Process for preparing a crystalline organic semiconductor material BASF SE (DE) 2019-03-05 US claimed
CN-102351851-B 4-(5-dimethylaminothiophenevinyl)methylpyridine sulfonate, second-order nonlinear optical crystal of 4-(5-dimethylaminothiophenevinyl)methylpyridine sulfonate, and their preparation methods UNIV BEIJING SCIENCE & TECH 2013-09-11 CN claimed
CN-102351851-A 4-(5-dimethylaminothiophenevinyl)methylpyridine sulfonate, second-order nonlinear optical crystal of 4-(5-dimethylaminothiophenevinyl)methylpyridine sulfonate, and their preparation methods UNIV BEIJING SCIENCE & TECH 2012-02-15 CN claimed
CN-1183098-C 3-amino-3-aryl-1-alcohol derivatives and preparation and use thereof 2005-01-05 CN claimed
US-6831075-B2 Administering to a host for inhibiting kinase activity a 5-heterocylcic subustituted pyrazolone derivative CEPHALON, INC. 2004-12-14 US claimed
US-20030162775-A1 Heterocyclic substituted pyrazolones CEPHALON, INC. 2003-08-28 US claimed
CN-1387528-A Heterocyclic substd, pyrazolones CEPHALON INC (US) 2002-12-25 CN claimed
US-6455525-B1 Heterocyclic substituted pyrazolones CEPHALON, INC. 2002-09-24 US claimed
EP-1226141-A1 HETEROCYCLIC SUBSTITUTED PYRAZOLONES CEPHALON, INC. (US) 2002-07-31 EP claimed
WO-2001032653-A1 HETEROCYCLIC SUBSTITUTED PYRAZOLONES CEPHALON, INC. (US) 2001-05-10 WO claimed
WO-1995020637-A2 HYDROCARBON OIL-AQUEOUS FUEL AND ADDITIVE COMPOSITIONS MEG S.N.C. DI SCOPELLITI SOFIA & C. (IT) 1995-08-03 WO claimed
EP-3784670-B1 NLRP3 MODULATORS INNATE TUMOR IMMUNITY INC (US) 2023-11-29 EP disclosed
EP-3183250-B1 PROCESS FOR PREPARING CRYSTALLINE ORGANIC SEMICONDUCTOR MATERIAL CLAP CO LTD (KR) 2023-10-04 EP disclosed
US-20230309366-A1 COMPOUND, SENSOR, SENSOR EMBEDDED DISPLAY PANEL, AND ELECTRONIC DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-09-28 US disclosed
CN-114874198-B Aβ fluorescent probe based on rhodamine-copper complex and application thereof 黄淮学院 2023-08-25 CN disclosed
US-4908435-A Aromatic disazo compounds having strong infra-red absorption IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-03-13 US disclosed
US-4894367-A CARDIOVASCULAR DISORDERS AMERICAN CYANAMID COMPANY (US) 1990-01-16 US disclosed
US-4883816-A SULFONYL DERIVATIVES AMERICAN CYANAMID COMPANY (US) 1989-11-28 US disclosed
EP-0206621-B1 PROCESS FOR DISPROPORTIONATING SILANES MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-11-15 EP disclosed
US-4762942-A AMINO SUBSTITUTED, INNER SALTS AMERICAN CYANAMID CO. (US) 1988-08-09 US disclosed