SCHEMBL2643600

SCHEMBL2643600

CCS(=O)(=O)c1ccc(Oc2cc3[nH]c(-c4ccccn4)nc3cc2Oc2ccccc2C(F)F)cn1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 19/20 0.52
CBFB Q13951 1/20 0.47

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
SCHEMBL2646320 0.92 GCK (0.48) GCKCBFB
SCHEMBL2644457 0.89 GCK (0.54) GCKCBFB
SCHEMBL2646390 0.89 GCK (0.54) GCKCBFB
SCHEMBL2643839 0.88 GCK (0.50) GCKCBFB
SCHEMBL2645339 0.87 GCK (0.52) GCKCBFB
SCHEMBL2643977 0.87 GCK (0.53) GCKCBFB
SCHEMBL2645557 0.87 GCK (0.52) GCKCBFB
SCHEMBL2644799 0.87 GCK (0.54) GCKCBFB
SCHEMBL2646067 0.87 GCK (0.53) GCKCBFB
SCHEMBL2644519 0.86 CBFB (0.45) GCKCBFB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1702919-B1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE MSD KK (JP) 2012-05-30 EP disclosed
EP-1702919-A1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-09-20 EP disclosed