SCHEMBL105390

SCHEMBL105390

CC(C)CCC#N

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
SCHEMBL28813789 0.91 TSHR (0.59)
SCHEMBL127102 0.84
SCHEMBL27872970 0.83 SLC1A2 (0.47)
SCHEMBL28152195 0.83 TSHR (0.44)
SCHEMBL28152196 0.83 TSHR (0.44)
Fluoride SCHEMBL29092358 0.81 TSHR (0.48)
Ammonia Solution, Strong SCHEMBL21462229 0.81 TSHR (0.48)
SCHEMBL364355 0.81
Fluoride SCHEMBL28481354 0.81 TSHR (0.48)
SCHEMBL6796953 0.81

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

Appears in 6077 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119771391-A Solid super-base catalyst, preparation method thereof and nitrile hydrolysis esterification method 中国天辰工程有限公司 2025-04-08 CN claimed
CN-118001879-A Application of nano copper alloy in filtering harmful substances in cigarette smoke 广东合一新材料研究院有限公司 2024-05-10 CN claimed
CN-117296178-A Nonaqueous electrolyte for lithium secondary battery and lithium secondary battery comprising same 株式会社LG新能源 2023-12-26 CN claimed
EP-4250403-A1 DISPERSANT FOR LITHIUM ION BATTERY, PREPARATION METHOD THEREFOR, POSITIVE ELECTRODE SLURRY AND LITHIUM ION BATTERY BYD Company Limited (CN) 2023-09-27 EP claimed
US-20230295410-A1 DISPERSANT FOR LITHIUM ION BATTERY AND PREPARATION METHOD THEREOF, POSITIVE SLURRY, AND LITHIUM ION BATTERY BYD COMPANY LIMITED (CN) 2023-09-21 US claimed
CN-109369947-A A kind of wear resistant resin eyeglass and preparation method thereof 镇江奥视达光学有限公司 2019-02-22 CN claimed
CN-105518058-A Organo-modified silicone polymers and hydrogels containing the same MOMENTIVE PERFORMANCE MAT INC 2016-04-20 CN claimed
CN-104231120-B A kind of long chain branching high cis-1,4-polyisoprene and preparation method thereof BEIJING UNIVERSITY OF CHEMICAL TECHNOLOGY (CN) 2016-03-30 CN claimed
CN-105418360-A Method for preparing 1,1,1,3,3-pentachlorobutane XI'AN MODERN CHEMISTRY RES INST 2016-03-23 CN claimed
CN-105237332-A Method for preparing 1,1,1,3,3-pentachloropropane XIAN MODERN CHEMISTRY RES INST 2016-01-13 CN claimed
CN-1028431-C Continuous process including recycle stream treatment for prodn. of high impact polystyrene FINA TECHNOLOGY (US) 1995-05-17 CN claimed
CN-1094398-A 5, 6-disubstituted-3-pyridylmethyl ammonium halides for the preparation of 5- (substituted methyl) -2, 3-pyridinedicarboxylic acids AMERICAN CYANAMID CO (US) 1994-11-02 CN claimed
CN-1090293-A The aqueous polymer dispersion that is used for varnish BOLLIG & KEMPER (DE) 1994-08-03 CN claimed
CN-1088019-A Low viscosity magnetorheological materials LORD CORP (US) 1994-06-15 CN claimed
WO-1994010692-A1 LOW VISCOSITY MAGNETORHEOLOGICAL MATERIALS LORD CORPORATION (US) 1994-05-11 WO claimed
CN-1057847-A The lower optical densities polymkeric substance that photoresist material and optical application are used and the preparation method of multipolymer HOECHST CELANESE CORP (US) 1992-01-15 CN claimed
CN-1012955-B PRODUCTION TECHNOLOGY IMPROVED FOR AZODIISOHEPTONITRILE BEIJING CHEMICAL PLANT (CN) 1991-06-26 CN claimed
CN-1036211-A The continuous processing of handling with cycling stream prepares high impact polystyrene FINA TECHNOLOGY (US) 1989-10-11 CN claimed
US-3982923-A THIOCARBAMATE STAUFFER CHEMICAL COMPANY (US) 1976-09-28 US claimed
US-3969374-A Process for preparing amino-anthraquinones BAYER AKTIENGESELLSCHAFT (DT) 1976-07-13 US claimed