SCHEMBL9070819

SCHEMBL9070819

COc1cc(C(=O)Nc2nccs2)cc(S(=O)(=O)CCCc2ccccc2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.47
NPC1 O15118 5/20 0.47
SMN1; SMN2 Q16637 7/20 0.46
BRD4 O60885 1/20 0.46
MAPT P10636 1/20 0.46
POLB P06746 2/20 0.45
MAPK1 P28482 2/20 0.45
ALDH1A1 P00352 3/20 0.45
LMNA P02545 2/20 0.45
GAA P10253 1/20 0.45
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SCD O00767 1/20 0.43
HPGD P15428 2/20 0.43
KCNK3 O14649 1/20 0.43
KCNK9 Q9NPC2 1/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GBA1 P04062 1/20 0.43

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
SCHEMBL9070870 0.86 RAB9A (0.53) RAB9ANPC1SMN1; SMN2BRD4MAPT
SCHEMBL9070886 0.86 RAB9A (0.46) RAB9ANPC1SMN1; SMN2MAPTPOLB
SCHEMBL9070890 0.86 GCK (0.50) RAB9ANPC1SMN1; SMN2MAPTPOLB
SCHEMBL2667741 0.85 GCK (0.50) RAB9ANPC1SMN1; SMN2POLBMEN1
SCHEMBL2667498 0.83 SCD (0.51) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL9070822 0.81 RAB9A (0.47) RAB9ANPC1SMN1; SMN2BRD4MAPT
SCHEMBL9070823 0.80 GCK (0.54) GCK
SCHEMBL2667540 0.77 NPC1 (0.51) RAB9ANPC1SMN1; SMN2BRD4MAPT
SCHEMBL9070830 0.76 NPC1 (0.53) RAB9ANPC1SMN1; SMN2POLBALDH1A1
SCHEMBL2667715 0.76 NPC1 (0.50) RAB9ANPC1SMN1; SMN2BRD4MAPT

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