SCHEMBL104305

SCHEMBL104305

COC(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
SCHEMBL4741885 1.00
SCHEMBL6590316 1.00
Acetonitrile SCHEMBL3613982 0.94
SCHEMBL23929031 0.80
Dimethylformamide SCHEMBL5510863 0.80 TSHR (0.41)
SCHEMBL6796444 0.78
SCHEMBL264243 0.74
SCHEMBL27623259 0.71
SCHEMBL6286107 0.69
SCHEMBL19646063 0.69

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 2890 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026100817-A1 ELECTROLYTE FOR SECONDARY BATTERY AND SECONDARY BATTERY COMPRISING SAME 동화일렉트로라이트 주식회사 2026-05-15 WO claimed
WO-2026100816-A1 ELECTROLYTE FOR SECONDARY BATTERY AND SECONDARY BATTERY COMPRISING SAME 동화일렉트로라이트 주식회사 2026-05-15 WO claimed
EP-4718555-A1 COMPOSITION FOR FORMING SOLID ELECTROLYTE, SOLID ELECTROLYTE AND LITHIUM SECONDARY BATTERY SK On Co., Ltd. (KR) 2026-04-01 EP claimed
EP-4718556-A1 COMPOSITION FOR FORMING SOLID ELECTROLYTE, SOLID ELECTROLYTE AND LITHIUM SECONDARY BATTERY SK On Co., Ltd. (KR) 2026-04-01 EP claimed
US-20260088351-A1 COMPOSITION FOR FORMING SOLID ELECTROLYTE, SOLID ELECTROLYTE AND LITHIUM SECONDARY BATTERY SK ON CO LTD (KR) 2026-03-26 US claimed
US-20260088341-A1 COMPOSITION FOR FORMING SOLID ELECTROLYTE, SOLID ELECTROLYTE AND LITHIUM SECONDARY BATTERY SK ON CO LTD (KR) 2026-03-26 US claimed
EP-3847144-B1 METHOD FOR THE PRODUCTION OF MTBE AND 1-BUTENE FROM A C4 FEED STREAM SABIC GLOBAL TECHNOLOGIES BV (NL) 2025-07-02 EP claimed
US-12334500-B2 Rechargeable metal halide battery INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2025-06-17 US claimed
CN-112955420-B Process for producing MTBE and 1-butene from a C4 feed stream 沙特基础全球技术有限公司 2025-05-27 CN claimed
CN-120048996-A Electrolyte for lithium ion battery and lithium ion battery 江苏天合储能有限公司 2025-05-27 CN claimed
US-4447318-A USING POLAR SOLVENT NIPPON ZEON CO., LTD. (JP) 1984-05-08 US claimed
EP-0055361-A1 Process for the simultaneous preparation of alkyl tert.-butyl ether and recovery of butadiene BASF Aktiengesellschaft (DE) 1982-07-07 EP claimed
EP-0017118-B1 PROCESS FOR OBTAINING A CONJUGATED DIOLEFIN FROM A C 4 OR C 5 HYDROCARBON MIXTURE BASF Aktiengesellschaft (DE) 1982-02-03 EP claimed
US-4313005-A COMPLEXING WITH A BORON COMPOUND AIR PRODUCTS AND CHEMICALS, INC. (US) 1982-01-26 US claimed
US-4310388-A EXTRACTIVE DISTILLATION USING AN AMIDE SOLVENT AND ACETONITRILE BASF AKTIENGESELLSCHAFT (DE) 1982-01-12 US claimed
US-4250089-A Process for diazotizing aromatic amines BAYER AKTIENGESELLSCHAFT (DE) 1981-02-10 US claimed
US-4248775-A BY REACTING AN AZO-METHINE DYE BASE WITH A DIALKYL SULFATE BAYER AKTIENGESELLSCHAFT (DE) 1981-02-03 US claimed
EP-0017118-A1 Process for obtaining a conjugated diolefin from a C 4 or C 5 hydrocarbon mixture BASF Aktiengesellschaft (DE) 1980-10-15 EP claimed
US-4141925-A Separating unequally saturated hydrocarbons with monovalent copper salt solutions in β-methoxypropionitrile PAVLOV STANISLAV J 1979-02-27 US claimed
US-4020114-A Process for separating butadiene from C4 hydrocarbons streams obtained by stream-cracking SNAM PROGETTI S.P.A. (IT) 1977-04-26 US claimed