SCHEMBL29860147

SCHEMBL29860147

COCCc1ccc(-c2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.38
CYP3A4 P08684 5/20 0.38
CYP2C19 P33261 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
MAPK1 P28482 1/20 0.38
USP2 O75604 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CCNB2 O95067 2/20 0.33
CCNE2 O96020 2/20 0.33
CDK1 P06493 2/20 0.33
CDK4 P11802 2/20 0.33
CCNB1 P14635 2/20 0.33
CCND1 P24385 2/20 0.33
CCNE1 P24864 2/20 0.33
CDK2 P24941 2/20 0.33
CCNB3 Q8WWL7 2/20 0.33
CCNA2 P20248 1/20 0.33
CCNA1 P78396 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP2D6 P10635 2/20 0.33

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
SCHEMBL391681 1.00 CYP1A2 (0.38) CYP1A2CYP3A4CYP2C19CLK4MAPK1
SCHEMBL29860074 0.87 MYC (0.35) CCNB2CCNE2CDK1CDK4CCNB1
SCHEMBL267070 0.87 MYC (0.35) CCNB2CCNE2CDK1CDK4CCNB1
SCHEMBL393442 0.84 ALDH1A1 (0.32) CCNB2CCNE2CDK1CDK4CCNB1
SCHEMBL2742083 0.80 PDE7A (0.35) CCNB2CCNE2CDK1CDK4CCNB1
SCHEMBL15476088 0.79 NOS3 (0.37) CYP1A2CYP3A4CYP2C19CLK4MAPK1
SCHEMBL15475516 0.78 EGFR (0.34) CYP1A2CYP3A4CYP2C19CLK4MAPK1
SCHEMBL62367 0.76 IDO1 (0.42) CYP1A2CYP3A4CYP2C19MAPK1USP2
SCHEMBL29350011 0.76 IDO1 (0.42) CYP1A2CYP3A4CYP2C19MAPK1USP2
SCHEMBL990306 0.73 CNR1 (0.43) KDM4EALDH1A1TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022209858-A1 UV RADIATION SENSING MEMBER AND UV RADIATION SENSING KIT 富士フイルム株式会社 2022-10-06 WO disclosed