SCHEMBL2667585

SCHEMBL2667585

COCC(C)Oc1cc(C(=O)Nc2nc(C)cs2)cc(Oc2ccc(F)cc2)n1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCK P35557 13/20 0.58
GRM5 P41594 5/20 0.57
CYP3A4 P08684 1/20 0.48
DRD3 P35462 1/20 0.48
SLC6A3 Q01959 1/20 0.48
KCNH2 Q12809 2/20 0.46
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL2667811 1.00 GCK (0.58) GCKGRM5CYP3A4DRD3SLC6A3
SCHEMBL2667825 0.92 GRM5 (0.58) GCKGRM5CYP3A4DRD3SLC6A3
SCHEMBL9071026 0.90 GRM5 (0.55) GCKGRM5KCNH2NPC1HPGD
SCHEMBL2667726 0.89 GCK (0.64) GCKGRM5CYP3A4DRD3SLC6A3
SCHEMBL2667538 0.89 GCK (0.50) GCKGRM5KCNH2NPC1RAB9A
SCHEMBL2667580 0.89 GCK (0.50) GCKGRM5KCNH2NPC1RAB9A
SCHEMBL2667558 0.88 GCK (0.56) GCKGRM5KCNH2NPC1RAB9A
SCHEMBL2667584 0.87 MAPK1 (0.54) GCKCYP3A4KCNH2SMN1; SMN2
SCHEMBL2667545 0.87 GCK (0.54) GCKGRM5KCNH2HPGDSMN1; SMN2
SCHEMBL2668013 0.86 GRM5 (0.63) GCKGRM5NPC1HPGDRAB9A

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-2009083553-A1 AZINE COMPOUNDS AS GLUCOKINASE ACTIVATORS RHEOSCIENCE A/S (DK) 2009-07-09 WO disclosed