SCHEMBL2644754

SCHEMBL2644754

CC(=O)N1CCC(F)C1c1cc2[nH]c(-c3ccccn3)nc2cc1Oc1ccc(-c2nnn(C)n2)cc1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 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
SCHEMBL2646495 0.88 GCK (0.80) GCK
SCHEMBL2643640 0.86 GCK (0.62) GCK
SCHEMBL2643642 0.86 GCK (0.62) GCK
SCHEMBL2643646 0.86 GCK (0.62) GCK
SCHEMBL926092 0.86 GCK (0.65) GCK
SCHEMBL2644095 0.84 GCK (0.70) GCK
SCHEMBL2644033 0.82 GCK (0.69) GCK
SCHEMBL2646651 0.82 GCK (0.65) GCK
SCHEMBL2644526 0.82 GCK (0.73) GCK
SCHEMBL2645747 0.82 GCK (0.75) 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