SCHEMBL369674

SCHEMBL369674

C=CCc1nc(N)nc(CC=C)n1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 1/20 0.40
CYP1A2 P05177 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
IMPDH2 P12268 1/20 0.32
CDK1 P06493 1/20 0.30
CCNB1 P14635 1/20 0.30
MGMT P16455 1/20 0.30
CCNA2 P20248 1/20 0.30
CDK2 P24941 1/20 0.30
CCNA1 P78396 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
SCHEMBL486583 0.95 CASP1 (0.46) CASP1CYP1A2NPSR1IMPDH2CDK1
Phosphoric Acid SCHEMBL27849514 0.87 CYP1A2 (0.36) CASP1CYP1A2NPSR1
SCHEMBL456737 0.86 ALDH1A1 (0.33) NPSR1
SCHEMBL27875835 0.84 CASP1 (0.33) CASP1
SCHEMBL10886277 0.80 GAA (0.37) CASP1NPSR1
SCHEMBL27892415 0.78 MAPT (0.40) CDK1CCNB1MGMTCCNA2CDK2
SCHEMBL4364386 0.78 GAA (0.39) CYP1A2NPSR1CCNA2CDK2
SCHEMBL7590048 0.75 ADORA2A (0.36) IMPDH2
SCHEMBL4038720 0.75
SCHEMBL28801657 0.74 NOS1 (0.35)

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101831082-B Preparation method of reactive phosphorus-nitrogen intumescent flame retardant UNIV SOUTH CHINA TECH 2012-05-09 CN claimed
CN-114300687-B Water-based composite binder, preparation and application 北京壹金新能源科技有限公司 2022-05-06 CN disclosed
CN-114300687-A Water-based composite binder, preparation and application 北京壹金新能源科技有限公司 2022-04-08 CN disclosed
CN-108571689-A A kind of photovoltaic illumination device 嘉兴旭日光电科技有限公司 2018-09-25 CN disclosed
CN-108250668-A Metal bonding resin combination and its with metal bonding molded product and manufacturing method 东丽先端材料研究开发(中国)有限公司 2018-07-06 CN disclosed
CN-107708998-A metal-resin composite 株式会社钟化 2018-02-16 CN disclosed
EP-2407460-B1 N-TRIAZINYLAMMONIUM SALTS, A METHOD OF PREPARATION AND USES THEREOF POLITECHNIKA LODZKA (PL) 2013-07-17 EP disclosed
CN-101831082-B Preparation method of reactive phosphorus-nitrogen intumescent flame retardant UNIV SOUTH CHINA TECH 2012-05-09 CN disclosed
EP-2407460-A1 N-Triazinylammonium salts, a method of preparation and uses thereof Politechnika Lódzka (PL) 2012-01-18 EP disclosed
EP-2327700-A1 Dialkyl triazinamines and use thereof for combating undesired plant growth Bayer CropScience AG (DE) 2011-06-01 EP disclosed
US-20100292469-A1 PROCESS FOR THE PREPARATION OF N-TRIAZINYLAMMONIUM SALTS ITALVELLUTI S.P.A. (IT) 2010-11-18 US disclosed
EP-1951691-A1 PROCESS FOR THE PREPARATION OF N-TRIAZINYLAMMONIUM SALTS Italvelluti S.p.A. (IT) 2008-08-06 EP disclosed
WO-2007051496-A1 PROCESS FOR THE PREPARATION OF N-TRIAZINYLAMMONIUM SALTS ITALVELLUTI S.P.A. (IT) 2007-05-10 WO disclosed