SCHEMBL13891597

SCHEMBL13891597

COCC(C)Oc1cc(Oc2cccc(C(=O)NCc3ncc[nH]3)c2)cc(C(=O)Nc2nccs2)c1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 19/20 0.63
▸ KCNH2 Q12809 2/20 0.61
▸ NPC1 O15118 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL1147142 1.00 GCK (0.63) GCKKCNH2NPC1HPGDRAB9A
SCHEMBL1146875 0.92 GCK (0.67) GCKKCNH2
SCHEMBL13891595 0.92 GCK (0.67) GCKKCNH2
SCHEMBL1147144 0.89 NPC1 (0.51) GCKKCNH2NPC1HPGDRAB9A
SCHEMBL1147195 0.88 GCK (0.71) GCKKCNH2NPC1HPGDRAB9A
SCHEMBL13891577 0.88 GCK (0.71) GCKKCNH2NPC1HPGDRAB9A
SCHEMBL13891583 0.85 GCK (0.74) GCKKCNH2
SCHEMBL12858465 0.85 GCK (0.74) GCKKCNH2
SCHEMBL2658987 0.84 GCK (0.63) GCKKCNH2
SCHEMBL13891674 0.82 GCK (0.70) GCKKCNH2NPC1HPGDRAB9A

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-2048137-A1 Benzamide derivatives and their use as glucokinase activating agents. AstraZeneca AB (SE) 2009-04-15 — — EP disclosed
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