SCHEMBL9070877

SCHEMBL9070877

COCC(C)Oc1cc(C(=O)Nc2nncs2)cc(OC(C)C)n1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.51
KDM4E B2RXH2 1/20 0.45
LMNA P02545 2/20 0.44
GCK P35557 6/20 0.44
ALDH1A1 P00352 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GRM5 P41594 2/20 0.43
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KCNH2 Q12809 2/20 0.41
AQP4 P55087 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL9070878 1.00 RAB9A (0.51) RAB9AKDM4ELMNAGCKALDH1A1
SCHEMBL9070881 1.00 RAB9A (0.51) RAB9AKDM4ELMNAGCKALDH1A1
SCHEMBL2667616 0.89 GCK (0.51) RAB9AKDM4ELMNAGCKALDH1A1
SCHEMBL9070874 0.88 RAB9A (0.59) RAB9AKDM4ELMNAALDH1A1HSD17B10
SCHEMBL9070916 0.86 ALDH1A1 (0.45) RAB9AKDM4ELMNAGCKALDH1A1
SCHEMBL9070883 0.85 NOX1 (0.49) RAB9AKDM4ELMNAGCKALDH1A1
SCHEMBL9070891 0.85 NOX1 (0.49) RAB9AKDM4ELMNAGCKALDH1A1
SCHEMBL2667626 0.85 NOX1 (0.49) RAB9AKDM4ELMNAGCKALDH1A1
SCHEMBL2667596 0.84 RAB9A (0.49) RAB9AKDM4ELMNAALDH1A1HSD17B10
SCHEMBL2667507 0.83 GCK (0.62) RAB9AGCKALDH1A1NPC1SMN1; SMN2

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