SCHEMBL19774516

SCHEMBL19774516

COCc1cnc(NC(=O)c2cc(Oc3ccc(S(C)(=O)=O)cc3)cc(OC(C)C)c2)s1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 20/20 0.66
▸ KCNH2 Q12809 2/20 0.61

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
SCHEMBL3605637 0.91 GCK (0.68) GCKKCNH2
SCHEMBL12021699 0.89 GCK (0.61) GCKKCNH2
SCHEMBL12021712 0.89 GCK (0.65) GCKKCNH2
SCHEMBL12021707 0.88 GCK (0.64) GCKKCNH2
SCHEMBL12021654 0.83 GCK (0.67) GCKKCNH2
SCHEMBL1147249 0.82 GCK (0.74) GCKKCNH2
SCHEMBL13891541 0.82 GCK (0.74) GCKKCNH2
SCHEMBL2667446 0.81 GCK (0.62) GCKKCNH2
SCHEMBL4581136 0.81 GCK (0.61) GCKKCNH2
SCHEMBL1107459 0.81 GCK (0.74) 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
EP-1600442-B1 HETEROARYLCARBAMOYLBENZENE DERIVATIVE MSD KK (JP) 2018-01-17 — — EP disclosed
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