SCHEMBL113573

SCHEMBL113573

C1CN=C2CCCC2C1

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
SCHEMBL4613968 0.92 NISCH (0.35)
SCHEMBL15526124 0.90 NISCH (0.39)
SCHEMBL14993023 0.90 NISCH (0.39)
SCHEMBL29957 0.90 NISCH (0.39)
SCHEMBL4649825 0.90 NISCH (0.39)
SCHEMBL14993535 0.90
SCHEMBL9022039 0.90
SCHEMBL14993894 0.90
Hydrochloric Acid SCHEMBL4047505 0.88 NOS3 (0.38)
SCHEMBL15665415 0.87 NISCH (0.40)

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 1993 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3762369-B1 A PROCESS FOR PREPARATION OF FUNGICIDALLY ACTIVE TRIAZOLE COMPOUNDS UPL LTD (IN) 2024-12-11 EP claimed
EP-4392411-A1 PROCESS FOR THE PREPARATION OF CHLOROALKYL SUBSTITUTED CYCLIC AMINES Hovione Farmaciencia SA (PT) 2024-07-03 EP claimed
WO-2024126674-A1 PROCESS FOR THE PREPARATION OF RELUGOLIX MEDICHEM, S.A. (ES) 2024-06-20 WO claimed
WO-2024069084-A1 OPTIONALLY SILYLATED IONIC POLYURETHANE(S) BOSTIK SA (FR) 2024-04-04 WO claimed
WO-2024033348-A1 COMBINATION OF CATALYTIC COMPONENTS POLYU GMBH (DE) 2024-02-15 WO claimed
WO-2024003383-A1 METHOD OF FAST CURING A POLYTHIOURETHANE BASED SUBSTRATE USING A DELAYED-ACTION CATALYST ESSILOR INTERNATIONAL (FR) 2024-01-04 WO claimed
EP-4288439-A1 IONIC PLASTIC CRYSTALS, COMPOSITIONS COMPRISING SAME, METHODS FOR MANUFACTURING SAME AND USES THEREOF Hydro-Québec (CA) 2023-12-13 EP claimed
EP-4247813-A1 PROCESS FOR PREPARING 7-CHLORO-6-FLUORO-1-(2-ISOPROPYL-4-METHYLPYRIDIN-3- YL)PYRIDOF[2,3-D]PYRIMIDINE-2,4(1H,3H)-DIONE Amgen, Inc (US) 2023-09-27 EP claimed
EP-4214190-A1 METHOD FOR PREPARING ARYLVINYLSULPHONES Kemira OYJ (FI) 2023-07-26 EP claimed
WO-2022115971-A9 METHODS FOR EXTRACTION, PROCESSING, AND PURIFICATION OF MINOR CANNABINOID COMPOUNDS FROM CANNABIS NECTAR HEALTH SCIENCES INC. (CA) 2023-04-20 WO claimed
EP-0977769-A2 A PROCESS FOR THE SYNTHESIS OF MODIFIED P-CHIRAL NUCLEOTIDE ANALOGUES POLSKA AKADEMIA NAUK CENTRUM BADAN MOLEKULARNYCH I MAKROMOLEKULARNYCH (PL) 2000-02-09 EP claimed
WO-1999061405-A1 AN IMPROVED SYNTHESIS AND PURIFICATION OF (R*,R*)-2-[ (DIMETHYLAMINO) METHYL]-1-( 3-METHOXYPHENYL) CYCLOHEXANOL HYDROCHLORIDE MALLINCKRODT INC. (US) 1999-12-02 WO claimed
EP-0912576-A1 PROCESS FOR SYNTHESIZING CARBAPENEM ANTIBIOTICS Merck & Co., Inc. (US) 1999-05-06 EP claimed
WO-1998056802-A1 4'-SUBSTITUTED-9-DEOXO-9A-AZA-9A-HOMOERYTHROMYCIN A DERIVATIVES PFIZER PRODUCTS INC. (US) 1998-12-17 WO claimed
WO-1998056801-A1 C-4''-SUBSTITUTED MACROLIDE DERIVATIVES PFIZER PRODUCTS INC. (US) 1998-12-17 WO claimed
WO-1998049179-A2 A PROCESS FOR THE SYNTHESIS OF MODIFIED P-CHIRAL NUCLEOTIDE ANALOGUES POLSKA AKADEMIA NAUK, CENTRUM BADAN MOLEKULARNYCH I MAKROMOLEKULARNYCH (PL) 1998-11-05 WO claimed
WO-1998002439-A1 PROCESS FOR SYNTHESIZING CARBAPENEM ANTIBIOTICS MERCK & CO., INC. (US) 1998-01-22 WO claimed
EP-0336762-B1 Process for acrylamidoacylation of alcohols MINNESOTA MINING & MFG (US) 1997-05-28 EP claimed
WO-1996033178-A1 PROCESS FOR THE PREPARATION OF TRIAZOLONES SCHERING CORPORATION (US) 1996-10-24 WO claimed
WO-1996012723-A1 PROCESS FOR PREPARING ALKYLSILYL OR ARYLSILYL ETHERS FMC CORPORATION (US) 1996-05-02 WO claimed