SCHEMBL29957

SCHEMBL29957

C1CCC2=NCCCC2CC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.39
NOS3 P29474 6/20 0.36
NOS1 P29475 6/20 0.36
NOS2 P35228 6/20 0.36
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
ADRA1A P35348 1/20 0.31
USP2 O75604 1/20 0.31
INMT O95050 1/20 0.31
CRBN Q96SW2 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL15526124 1.00 NISCH (0.39) NISCHNOS3NOS1NOS2MEN1
SCHEMBL14993023 1.00 NISCH (0.39) NISCHNOS3NOS1NOS2MEN1
Hydrochloric Acid SCHEMBL4047505 0.98 NOS3 (0.38) NISCHNOS3NOS1NOS2MEN1
SCHEMBL4613968 0.98 NISCH (0.35) NISCHNOS3NOS1NOS2MEN1
SCHEMBL14993410 0.95 NOS3 (0.41) NISCHNOS3NOS1NOS2MEN1
SCHEMBL5011983 0.95 NOS3 (0.41) NISCHNOS3NOS1NOS2MEN1
SCHEMBL15743712 0.95 NOS3 (0.41) NISCHNOS3NOS1NOS2MEN1
SCHEMBL4649152 0.95 NOS3 (0.41) NISCHNOS3NOS1NOS2MEN1
SCHEMBL22477358 0.95 NOS3 (0.41) NISCHNOS3NOS1NOS2MEN1
SCHEMBL4611302 0.95 NOS3 (0.41) NISCHNOS3NOS1NOS2MEN1

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 7034 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-4384496-A1 FLOW SYNTHESIS PROCESS FOR THE PRODUCTION OF SULFONYLUREA COMPOUNDS Nelson Mandela University (ZA) 2024-06-19 EP claimed
WO-2024013382-A9 PROCESS FOR PREPARING BENZOIC ACID ESTERS AND INTERMEDIATES THEREOF ROKA FURADADA, S.L. (ES) 2024-04-18 WO claimed
EP-4334299-A1 PROCESS FOR THE PREPARATION OF ANTIBACTERIAL COMPOUNDS Discuva Ltd. (GB) 2024-03-13 EP claimed
EP-4330243-A1 RING CLOSURE OF BENZOQUINONES CONTAINING AN UNSATURATED SIDE CHAIN USING A BASIC CATALYST DSM IP Assets B.V. (NL) 2024-03-06 EP claimed
WO-2024033348-A1 COMBINATION OF CATALYTIC COMPONENTS POLYU GMBH (DE) 2024-02-15 WO claimed
WO-2024020355-A2 AZLACTONE-BASED POLYMERS AS A SCAFFOLD FOR DIVERSE APPLICATIONS IN DRUG AND GENE DELIVERY UNIVERSITY OF MISSISSIPPI (US) 2024-01-25 WO claimed
WO-2024013382-A1 PROCESS FOR PREPARING BENZOIC ACID ESTERS AND INTERMEDIATES THEREOF ROKA FURADADA, S.L. (ES) 2024-01-18 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
WO-1998028317-A2 SYNTHESIS OF NUCLEOSIDES AND POLYNUCLEOTIDES RIBOZYME PHARMACEUTICALS, INC. (US) 1998-07-02 WO claimed
WO-1998000399-A1 NICKEL CATALYZED ADDITION OF -NH- CONTAINING COMPOUNDS TO VINYL AND ARYL HALIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-01-08 WO claimed
WO-1997016448-A1 PROCESS FOR PREPARING SUBSTITUTED AZETIDINONES MERCK & CO., INC. (US) 1997-05-09 WO 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
JP-H08501283-A 1996-02-13 JP claimed
EP-0647137-A1 GLYCINE RECEPTOR ANTAGONISTS AND THE USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1995-04-12 EP claimed
WO-1994000124-A1 GLYCINE RECEPTOR ANTAGONISTS AND THE USE THEREOF WEBER ECKARD (US) 1994-01-06 WO claimed
US-5026886-A Deprotonation of a bis(alkyl-substituted)biaryl compound and reacting the biaryl anion with a Group 5 element compound EASTMAN KODAK COMPANY (US) 1991-06-25 US claimed
US-4869772-A ADHESION PROMOTERS FOR USE WITH A CYANOACRYLATE ADHESIVE LOCTITE (IRELAND) LTD. (IE) 1989-09-26 US claimed