SCHEMBL14242542

SCHEMBL14242542

NC(=O)C1=CCC(c2cc(NC3CC3)n3ncc(/C=C(\NC=O)C(N)=O)c3n2)S1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CSNK2B P67870 1/20 0.40
BCL6 P41182 2/20 0.32
CSNK2A1 P68400 1/20 0.30

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
SCHEMBL14243106 0.86 CSNK2B (0.34) CSNK2BBCL6
SCHEMBL14242485 0.84 CSNK2B (0.34) CSNK2BBCL6
SCHEMBL14242865 0.82 CSNK2B (0.38) CSNK2BBCL6
SCHEMBL14243124 0.82 CSNK2B (0.48) CSNK2BBCL6CSNK2A1
SCHEMBL14243319 0.79 CSNK2B (0.52) CSNK2BBCL6CSNK2A1
SCHEMBL14242628 0.78 CSNK2B (0.50) CSNK2BBCL6CSNK2A1
SCHEMBL14242464 0.77 CSNK2B (0.44) CSNK2BBCL6CSNK2A1
SCHEMBL14242544 0.77 CSNK2B (0.51) CSNK2BBCL6CSNK2A1
SCHEMBL14243301 0.75 CSNK2B (0.48) CSNK2BCSNK2A1
SCHEMBL14242545 0.74 CSNK2A1 (0.41) CSNK2BBCL6CSNK2A1

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-2012170827-A2 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS CYLENE PHARMACEUTICALS, INC. (US) 2012-12-13 WO disclosed