SCHEMBL2668902

SCHEMBL2668902

CCOCOc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc(C(=O)Nc2nc(CP(=O)(O)OCC)cs2)c1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.65
KCNH2 Q12809 1/20 0.65

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
SCHEMBL2669028 0.93 GCK (0.66) GCKKCNH2
SCHEMBL1107726 0.87 GCK (0.82) GCKKCNH2
SCHEMBL1107481 0.85 GCK (0.89) GCKKCNH2
SCHEMBL1107628 0.84 GCK (0.81) GCKKCNH2
SCHEMBL16473166 0.84 GCK (0.76) GCKKCNH2
SCHEMBL16473169 0.84 GCK (0.71) GCKKCNH2
SCHEMBL1107712 0.84 GCK (0.80) GCKKCNH2
SCHEMBL1107718 0.83 GCK (0.71) GCKKCNH2
SCHEMBL1107655 0.82 GCK (0.73) GCKKCNH2
SCHEMBL1107349 0.82 GCK (0.66) 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-2008005964-A2 PHOSPHONATE AND PHOSPHINATE COMPOUNDS AS GLUCOKINASE ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-10 WO disclosed