SCHEMBL16728839

SCHEMBL16728839

N#Cc1ccc(NC(=O)N2CCn3nc(-c4ccc(C5CC5)c(Cl)c4)c(C(=O)N=NN)c3C2)cc1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 20/20 0.63
▸ CSNK1D P48730 16/20 0.63

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
SCHEMBL16728786 0.92 CSNK1E (0.65) CSNK1ECSNK1D
SCHEMBL16728637 0.91 CSNK1E (0.66) CSNK1ECSNK1D
SCHEMBL16728670 0.84 CSNK1E (0.57) CSNK1ECSNK1D
SCHEMBL16728628 0.81 CSNK1E (0.54) CSNK1ECSNK1D
SCHEMBL18183975 0.81 CSNK1E (0.70) CSNK1ECSNK1D
SCHEMBL16722736 0.79 CSNK1E (0.82) CSNK1ECSNK1D
SCHEMBL16728666 0.78 CSNK1E (0.57) CSNK1ECSNK1D
SCHEMBL16722492 0.78 CSNK1E (0.83) CSNK1ECSNK1D
SCHEMBL16700588 0.78 CSNK1E (0.65) CSNK1ECSNK1D
SCHEMBL16728693 0.77 CSNK1E (1.00) 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
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