SCHEMBL16728787

SCHEMBL16728787

NN=NC(=O)c1c(-c2ccc(F)c(F)c2)nn2c1CN(C(=O)Nc1ccc(C(F)(F)F)cc1)CC2

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 19/20 0.57
▸ CSNK1D P48730 13/20 0.51

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
SCHEMBL18171226 0.89 CSNK1E (0.71) CSNK1ECSNK1D
SCHEMBL16728663 0.88 CSNK1E (0.53) CSNK1ECSNK1D
SCHEMBL16728631 0.82 CSNK1E (0.53) CSNK1ECSNK1D
SCHEMBL16728796 0.82 CSNK1E (0.65) CSNK1ECSNK1D
SCHEMBL18171174 0.78 CSNK1E (0.64) CSNK1ECSNK1D
SCHEMBL18648707 0.78 CSNK1E (0.68) CSNK1ECSNK1D
SCHEMBL16699920 0.78 CSNK1E (0.70) CSNK1ECSNK1D
SCHEMBL16699958 0.78 CSNK1E (0.82) CSNK1ECSNK1D
SCHEMBL16728565 0.77 CSNK1D (0.75) CSNK1ECSNK1D
SCHEMBL16728786 0.76 CSNK1E (0.65) 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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