SCHEMBL9070874

SCHEMBL9070874

COc1cc(C(=O)Nc2nncs2)cc(OC(C)C)n1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.59
LMNA P02545 2/20 0.48
NPC1 O15118 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 2/20 0.46
AQP4 P55087 1/20 0.43
ALDH1A1 P00352 4/20 0.42
HSD17B10 Q99714 3/20 0.42
HPGD P15428 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 1/20 0.39
TAAR1 Q96RJ0 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
SCHEMBL9070881 0.88 RAB9A (0.51) RAB9ALMNANPC1SMN1; SMN2KDM4E
SCHEMBL9070877 0.88 RAB9A (0.51) RAB9ALMNANPC1SMN1; SMN2KDM4E
SCHEMBL9070878 0.88 RAB9A (0.51) RAB9ALMNANPC1SMN1; SMN2KDM4E
SCHEMBL9070806 0.87 RAB9A (0.43) RAB9ALMNANPC1SMN1; SMN2KDM4E
SCHEMBL2667596 0.86 RAB9A (0.49) RAB9ALMNANPC1SMN1; SMN2KDM4E
SCHEMBL9070805 0.85 RAB9A (0.50) RAB9ALMNANPC1SMN1; SMN2KDM4E
SCHEMBL9070820 0.84 RAB9A (0.49) RAB9ALMNANPC1SMN1; SMN2KDM4E
SCHEMBL9070883 0.84 NOX1 (0.49) RAB9ALMNASMN1; SMN2KDM4EAQP4
SCHEMBL9070891 0.84 NOX1 (0.49) RAB9ALMNASMN1; SMN2KDM4EAQP4
SCHEMBL2667599 0.84 RAB9A (0.47) RAB9ALMNANPC1SMN1; SMN2KDM4E

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