SCHEMBL2667935

SCHEMBL2667935

COc1cc(C(=S)Nc2nc(C)cs2)cc(OC(C)C)n1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
MAPK10 P53779 1/20 0.41
GCK P35557 5/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 1/20 0.41
GRM5 P41594 4/20 0.40
HTT P42858 2/20 0.40
MEN1 O00255 1/20 0.39
ALOX12 P18054 1/20 0.39
KMT2A Q03164 1/20 0.39
RECQL P46063 1/20 0.38

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
SCHEMBL9070872 0.87 NPC1 (0.56) RAB9ANPC1SMN1; SMN2HPGDKDM4E
SCHEMBL9070806 0.81 RAB9A (0.43) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL2667933 0.81 LMNA (0.43) RAB9ANPC1SMN1; SMN2LMNATSHR
SCHEMBL9070889 0.77 RAB9A (0.44) RAB9ANPC1SMN1; SMN2HPGDLMNA
SCHEMBL2668013 0.75 GRM5 (0.63) RAB9ANPC1SMN1; SMN2HPGDKDM4E
SCHEMBL2667805 0.75 GRM5 (0.63) RAB9ANPC1SMN1; SMN2HPGDKDM4E
SCHEMBL9071035 0.74 MAPT (0.52) RAB9ANPC1SMN1; SMN2HPGDKDM4E
SCHEMBL9071034 0.74 MAPT (0.52) RAB9ANPC1SMN1; SMN2HPGDKDM4E
SCHEMBL9071036 0.74 MAPT (0.52) RAB9ANPC1SMN1; SMN2HPGDKDM4E
SCHEMBL2667597 0.74 NPC1 (0.51) RAB9ANPC1SMN1; SMN2HPGDKDM4E

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