SCHEMBL2667740

SCHEMBL2667740

COCCOc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc(C(=O)Nc2ncc(Oc3cccc(C(=O)N4CCC4)c3)s2)c1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.54
KCNH2 Q12809 3/20 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
SCHEMBL2667871 0.91 GCK (0.60) GCKKCNH2
SCHEMBL2667734 0.89 GCK (0.55) GCKKCNH2
SCHEMBL2667887 0.88 GCK (0.54) GCKKCNH2
SCHEMBL2667837 0.85 GCK (0.53) GCKKCNH2
SCHEMBL2667394 0.83 GCK (0.58) GCKKCNH2
SCHEMBL2667706 0.83 GCK (0.59) GCKKCNH2
SCHEMBL2667400 0.82 GCK (0.63) GCKKCNH2
SCHEMBL2667733 0.81 GCK (0.56) GCKKCNH2
SCHEMBL2667922 0.81 GCK (0.51) GCKKCNH2
SCHEMBL2667736 0.79 GCK (0.53) GCKKCNH2

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-2008154563-A1 1, 3 - DIHYDROXY SUBSTITUTED PHENYLAMIDE GLUCOKINASE ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-18 WO disclosed