SCHEMBL2646578

SCHEMBL2646578

CC(=O)N1CCCC1c1cc2[nH]c(-c3ccccn3)nc2cc1Oc1ccc(-c2ccccc2F)nc1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.80

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
SCHEMBL2643364 0.92 GCK (0.83) GCK
SCHEMBL2646682 0.91 GCK (0.85) GCK
SCHEMBL2644645 0.90 GCK (0.87) GCK
Trifluoroacetic Acid SCHEMBL2646385 0.89 GCK (0.80) GCK
SCHEMBL2646619 0.89 GCK (1.00) GCK
SCHEMBL926844 0.89 GCK (0.79) GCK
SCHEMBL1197960 0.88 GCK (0.84) GCK
SCHEMBL2644408 0.88 GCK (0.82) GCK
SCHEMBL2646557 0.88 GCK (0.82) GCK
SCHEMBL2646438 0.88 GCK (0.82) 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