SCHEMBL2645374

SCHEMBL2645374

CCS(=O)(=O)c1ccc(Oc2cc3[nH]c(-c4ccn(C)n4)nc3c(Oc3c(F)cccc3F)c2F)cn1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GCK P35557 16/20 0.39
DHODH Q02127 1/20 0.34
JMJD6 Q6NYC1 1/20 0.32
PARP1 P09874 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
SCHEMBL2646965 0.88 GCK (0.41) GCKDHODHJMJD6PARP1
SCHEMBL2655098 0.87 DHODH (0.35) GCKDHODH
SCHEMBL2645953 0.87 GCK (0.44) GCK
SCHEMBL2645403 0.87 CBFB (0.43) GCK
SCHEMBL2645709 0.87 GCK (0.39) GCKDHODH
SCHEMBL2644818 0.83 GCK (0.42) GCK
SCHEMBL3541075 0.82 GCK (0.42) GCK
SCHEMBL2645611 0.79 GCK (0.45) GCK
SCHEMBL2646268 0.77 GCK (0.40) GCK
SCHEMBL2644582 0.75 CBFB (0.44) GCK

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