SCHEMBL94704

SCHEMBL94704

C[C](C)C#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
SCHEMBL8073044 0.74
SCHEMBL11512484 0.74
SCHEMBL114673 0.74
SCHEMBL9961321 0.74
SCHEMBL6593530 0.74
SCHEMBL11880052 0.74
Water SCHEMBL11786429 0.70
SCHEMBL14868 0.70
SCHEMBL5036086 0.70
SCHEMBL9859678 0.70 TDP1 (1.00)

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 3215 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4709377-A2 METHODS OF TREATMENT AND DIAGNOSIS OF PARKINSON'S DISEASE ASSOCIATED WITH WILD-TYPE LRRK2 Neuron23, Inc. (US) 2026-03-18 EP claimed
CN-115380054-B Amine modified polymers, controlled radical polymerization for their preparation and their implementation 巴斯夫欧洲公司 2025-05-13 CN claimed
CN-119907798-A Novel substituted 2,3,4, 9-tetrahydro-1H-pyrido [3,4-B ] indolecarboxylic acid derivatives, process for their preparation and their therapeutic use 赛诺菲 2025-04-29 CN claimed
EP-4314155-B1 POLYMER COMPOSITION COMPRISING POLYACRYLIC BLOCK COPOLYMER AND AROMATIC BASED POLYALKYLENEOXIDE AS DISPERSANT BASF SE (DE) 2025-04-09 EP claimed
CN-119013277-A TYK2 degrading agent and application thereof 凯麦拉医疗公司 2024-11-22 CN claimed
US-20240383928-A1 PRODUCTION OF DIORGANOTIN DIHALIDES MERCK PATENT GMBH (DE) 2024-11-21 US claimed
WO-2024233854-A2 METHODS OF TREATMENT AND DIAGNOSIS OF PARKINSON'S DISEASE ASSOCIATED WITH WILD-TYPE LRRK2 NEURON23, INC. (US) 2024-11-14 WO claimed
CN-115023425-B Pesticidally active heterocyclic derivatives with sulfur containing substituents 先正达农作物保护股份公司 2024-07-09 CN claimed
CN-118284610-A Pyrazolotriazine derivatives as CDK9 inhibitors 原真股份有限公司 2024-07-02 CN claimed
CN-118265707-A Pesticidally active pyridazinone compounds 先正达农作物保护股份公司 2024-06-28 CN claimed
US-4567283-A EPOXYCYCLOHEXANOLS SHELL OIL COMPANY (US) 1986-01-28 US claimed
US-4554366-A HERBICIDES, PLANT GROWTH REGULATORS SHELL OIL COMPANY (US) 1985-11-19 US claimed
US-4542126-A Pesticidally active pyrimidin-5-yl-(thio)phosphoric acid ester-amides BAYER AKTIENGESELLSCHAFT (DE) 1985-09-17 US claimed
US-4542244-A Oxabicycloalkane herbicides SHELL OIL COMPANY (US) 1985-09-17 US claimed
EP-0135280-A2 New polymerization process and polymers produced thereby COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1985-03-27 EP claimed
EP-0118864-A1 Pyrimidinyl derivatives BAYER AG (DE) 1984-09-19 EP claimed
US-4401458-A HERBICIDES AND PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1983-08-30 US claimed
US-4241075-A Acaricidal 1-alkylthio-substituted and 1-phenylthio substituted 2-(phenoxyalkyl)-2-imidazolines CIBA-GEIGY CORPORATION (US) 1980-12-23 US claimed
EP-0009468-A1 1-Alkylthio- and 1-phenylthio-substituted 2-(phenoxyalkyl)-2-imidazolines, process for their preparation, compositions containing them, and their use against akarina CIBA-GEIGY AG (CH) 1980-04-02 EP claimed
US-3931165-A INSECTICIDES, HERBICIDES BARER SOL J 1976-01-06 US claimed