SCHEMBL16728684

SCHEMBL16728684

CCc1ccc(-c2nn3c(c2C(N)=O)CN(C(=O)Nc2ccc(C#N)cc2)CC3CN2CCOCC2)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 15/20 0.60
CSNK1D P48730 15/20 0.60
NAMPT P43490 1/20 0.38
MOK Q9UQ07 1/20 0.37
CREBBP Q92793 1/20 0.36
CCR2 P41597 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL18171287 0.91 CSNK1E (0.72) CSNK1ECSNK1D
SCHEMBL16728847 0.82 CSNK1E (0.79) CSNK1ECSNK1D
SCHEMBL16728838 0.81 CSNK1E (0.78) CSNK1ECSNK1D
SCHEMBL16722631 0.79 CSNK1E (0.77) CSNK1ECSNK1D
SCHEMBL16728780 0.78 CSNK1E (0.76) CSNK1ECSNK1D
SCHEMBL18183930 0.78 CSNK1E (0.76) CSNK1ECSNK1D
SCHEMBL16722713 0.78 CSNK1E (0.75) CSNK1ECSNK1D
SCHEMBL16728613 0.78 CSNK1E (0.74) CSNK1ECSNK1D
SCHEMBL16711376 0.77 CSNK1E (0.53) CSNK1ECSNK1D
SCHEMBL16711296 0.77 CSNK1E (0.53) CSNK1ECSNK1D

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-2015073767-A1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-05-21 WO disclosed