SCHEMBL2667540

SCHEMBL2667540

CS(=O)(=O)Oc1cc(C(=O)Nc2nccs2)cc(OCCc2ccccc2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
POLB P06746 2/20 0.49
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
SMN1; SMN2 Q16637 6/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SCD O00767 1/20 0.47
GCK P35557 1/20 0.47
HPGD P15428 2/20 0.47
KCNK3 O14649 1/20 0.47
KCNK9 Q9NPC2 1/20 0.47
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 1/20 0.46
GBA1 P04062 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
MAPK10 P53779 1/20 0.46

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
SCHEMBL2668008 0.86 NPC1 (0.51) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2667667 0.86 NPC1 (0.51) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL9070870 0.84 RAB9A (0.53) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL9070830 0.82 NPC1 (0.53) NPC1RAB9APOLBMEN1KMT2A
SCHEMBL2667715 0.82 NPC1 (0.50) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL9070875 0.81 GCK (0.56) NPC1RAB9APOLBSMN1; SMN2GCK
SCHEMBL2667946 0.78 SMN1; SMN2 (0.53) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL9070819 0.77 RAB9A (0.47) NPC1RAB9APOLBMEN1KMT2A
SCHEMBL9070795 0.76 GCK (0.47) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL9070971 0.76 GCK (0.53) NPC1RAB9AMEN1KMT2ASMN1; 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