SCHEMBL21130902

SCHEMBL21130902

CNC(O)C(C)(C)NC(=O)N1CCn2nc(-c3ccc(F)c(Cl)c3)c(C(N)=O)c2C1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 19/20 0.67
CSNK1D P48730 14/20 0.64

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
SCHEMBL16699622 0.91 CSNK1E (0.75) CSNK1ECSNK1D
SCHEMBL16711348 0.89 CSNK1E (0.84) CSNK1ECSNK1D
SCHEMBL16730621 0.89 CSNK1E (0.67) CSNK1ECSNK1D
SCHEMBL16711272 0.87 CSNK1E (0.73) CSNK1ECSNK1D
SCHEMBL16711319 0.87 CSNK1E (0.69) CSNK1ECSNK1D
SCHEMBL16711261 0.86 CSNK1E (0.71) CSNK1ECSNK1D
SCHEMBL16699891 0.86 CSNK1E (0.71) CSNK1ECSNK1D
SCHEMBL16699481 0.86 CSNK1E (0.68) CSNK1ECSNK1D
SCHEMBL16699774 0.86 CSNK1E (0.70) CSNK1ECSNK1D
SCHEMBL16711532 0.86 CSNK1E (0.70) 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
EP-3068785-B1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-06-26 EP disclosed