SCHEMBL2667710

SCHEMBL2667710

COC[C@H](C)Oc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc(C(=O)Nc2ncc(Oc3cccc(C#N)c3)s2)c1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.64
KCNH2 Q12809 3/20 0.64

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
SCHEMBL2667882 0.93 GCK (0.63) GCKKCNH2
SCHEMBL2668033 0.90 GCK (0.66) GCKKCNH2
SCHEMBL10329770 0.90 GCK (0.66) GCKKCNH2
SCHEMBL2667768 0.90 GCK (0.66) GCKKCNH2
SCHEMBL10329772 0.90 GCK (0.66) GCKKCNH2
SCHEMBL2667801 0.90 GCK (0.68) GCKKCNH2
SCHEMBL2667837 0.90 GCK (0.53) GCKKCNH2
SCHEMBL10329771 0.90 GCK (0.65) GCKKCNH2
SCHEMBL2667863 0.90 GCK (0.65) GCKKCNH2
SCHEMBL9071151 0.88 GCK (0.64) 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