SCHEMBL9070879

SCHEMBL9070879

COC[C@H](C)Oc1cc(C(=O)Nc2nccs2)cc(OC(C)C)n1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCK P35557 13/20 0.62
KCNH2 Q12809 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.51
BRD4 O60885 1/20 0.51
MAPT P10636 1/20 0.51
ALDH1A1 P00352 1/20 0.48
RAB9A P51151 3/20 0.47
MAPK1 P28482 1/20 0.47
NPC1 O15118 2/20 0.47

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
SCHEMBL2667507 1.00 GCK (0.62) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL2667508 1.00 GCK (0.62) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL2667721 0.89 GCK (0.56) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL2667615 0.89 GCK (0.58) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL2667602 0.88 SMN1; SMN2 (0.59) GCKSMN1; SMN2BRD4MAPTALDH1A1
SCHEMBL2667567 0.87 GCK (0.63) GCKKCNH2RAB9ANPC1
SCHEMBL9070913 0.87 GCK (0.56) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL9070865 0.87 SMN1; SMN2 (0.50) GCKKCNH2SMN1; SMN2BRD4MAPT
SCHEMBL2667796 0.86 GCK (0.78) GCKKCNH2
SCHEMBL2667588 0.86 GCK (0.66) GCKKCNH2ALDH1A1RAB9ANPC1

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