SCHEMBL13569342

SCHEMBL13569342

Cc1ccc([C@@H](O)CNC(=O)OCc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.55
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
LMNA P02545 2/20 0.55
CTSK P43235 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
HTT P42858 1/20 0.48
SYK P43405 1/20 0.47
BCAT2 O15382 1/20 0.47
CTSL P07711 2/20 0.46
CTSS P25774 2/20 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
SCHEMBL13569336 1.00 SMN1; SMN2 (0.55) SMN1; SMN2NPC1RAB9ALMNACTSK
SCHEMBL3226529 0.90 SMN1; SMN2 (0.62) SMN1; SMN2NPC1RAB9ALMNAL3MBTL1
SCHEMBL13569333 0.90 SMN1; SMN2 (0.62) SMN1; SMN2NPC1RAB9ALMNAL3MBTL1
SCHEMBL15317909 0.90 SMN1; SMN2 (0.62) SMN1; SMN2NPC1RAB9ALMNAL3MBTL1
SCHEMBL1554809 0.87 CA1 (0.58) SMN1; SMN2NPC1RAB9ALMNACTSK
SCHEMBL16553626 0.86 SMN1; SMN2 (0.52) SMN1; SMN2NPC1RAB9ALMNAHTT
SCHEMBL13569327 0.85 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9ALMNAL3MBTL1
SCHEMBL13569340 0.84 LMNA (0.48) SMN1; SMN2NPC1RAB9ALMNACTSK
SCHEMBL13569337 0.84 LMNA (0.48) SMN1; SMN2NPC1RAB9ALMNACTSK
SCHEMBL6216286 0.80 LMNA (0.58) SMN1; SMN2NPC1RAB9ALMNACTSK

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
US-7632972-B2 Reacting an acid and an amine; apoptosis; carbamate, and N-phenethyl-2-phenylacetamide THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLIONIS (US) 2009-12-15 US disclosed