SCHEMBL16730688

SCHEMBL16730688

CCc1cccc(-c2nn3c(c2C(N)=O)CN(C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC3)c1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 20/20 0.63
▸ CSNK1D P48730 15/20 0.62

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
SCHEMBL16708860 0.89 CSNK1E (0.79) CSNK1ECSNK1D
SCHEMBL16699414 0.83 CSNK1E (0.76) CSNK1ECSNK1D
SCHEMBL16699929 0.81 CSNK1E (0.84) CSNK1ECSNK1D
SCHEMBL16708859 0.80 CSNK1E (0.83) CSNK1ECSNK1D
SCHEMBL16730841 0.79 CSNK1E (0.44) CSNK1ECSNK1D
SCHEMBL16699467 0.79 CSNK1E (0.79) CSNK1ECSNK1D
SCHEMBL16711248 0.78 CSNK1E (1.00) CSNK1ECSNK1D
SCHEMBL16711295 0.78 CSNK1E (0.59) CSNK1ECSNK1D
SCHEMBL16708799 0.77 CSNK1E (1.00) CSNK1ECSNK1D
SCHEMBL16711194 0.77 CSNK1E (0.73) 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-2015073763-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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