SCHEMBL9070860

SCHEMBL9070860

Cc1csc(NC(=O)c2cc(Oc3ccc(S(C)(=O)=O)cc3)nc(O[C@H](C)CO)c2)n1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCK P35557 19/20 0.68
MEN1 O00255 1/20 0.58
NPC1 O15118 1/20 0.58
ALDH1A1 P00352 1/20 0.58
GAA P10253 1/20 0.58
RAB9A P51151 1/20 0.58
KMT2A Q03164 1/20 0.58
KCNH2 Q12809 3/20 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
SCHEMBL2667679 0.91 GCK (0.78) GCKMEN1NPC1ALDH1A1GAA
SCHEMBL2667829 0.89 GCK (0.55) GCKKCNH2
SCHEMBL3231097 0.89 GCK (0.83) GCKKCNH2
SCHEMBL2667813 0.87 MAPK1 (0.54) GCKMEN1ALDH1A1KMT2AKCNH2
SCHEMBL9070857 0.86 GCK (0.78) GCKKCNH2
SCHEMBL2667558 0.84 GCK (0.56) GCKMEN1NPC1ALDH1A1GAA
SCHEMBL9071034 0.83 MAPT (0.52) GCKMEN1NPC1ALDH1A1GAA
SCHEMBL9071036 0.83 MAPT (0.52) GCKMEN1NPC1ALDH1A1GAA
SCHEMBL9071035 0.83 MAPT (0.52) GCKMEN1NPC1ALDH1A1GAA
SCHEMBL2667545 0.82 GCK (0.54) GCKMEN1ALDH1A1KMT2AKCNH2

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