SCHEMBL11534377

SCHEMBL11534377

CC(=O)c1cccc(NC(=O)c2cc(C)on2)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.77
ALDH1A1 P00352 4/20 0.77
USP2 O75604 1/20 0.77
NPC1 O15118 6/20 0.73
RAB9A P51151 6/20 0.73
TP53 P04637 5/20 0.73
GAA P10253 1/20 0.73
MAPT P10636 3/20 0.69
CACNA1B Q00975 1/20 0.69
APBA1 Q02410 1/20 0.69
MAPK1 P28482 1/20 0.67
GLA P06280 2/20 0.65
HTT P42858 2/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
KMT2A Q03164 2/20 0.64
MEN1 O00255 1/20 0.64
HSD17B10 Q99714 2/20 0.63
NPSR1 Q6W5P4 1/20 0.61
RXFP1 Q9HBX9 1/20 0.61
HIF1A Q16665 1/20 0.57

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
SCHEMBL8267163 0.90 SMN1; SMN2 (0.88) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL11533648 0.85 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL10192041 0.85 SMN1; SMN2 (0.76) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL20620013 0.84 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1NPC1RAB9ATP53
SCHEMBL8267293 0.84 SMN1; SMN2 (0.74) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL8266868 0.83 RAB9A (0.77) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL8267156 0.83 SMN1; SMN2 (0.72) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL16486346 0.82 NPC1 (1.00) SMN1; SMN2ALDH1A1NPC1RAB9ATP53
SCHEMBL8267173 0.81 NPC1 (0.90) SMN1; SMN2ALDH1A1USP2NPC1RAB9A
SCHEMBL21695725 0.81 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1USP2NPC1RAB9A

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-4137321-A Isoxazole carboxamides of m-aminotetramisole as anthelmintics PFIZER INC. (US) 1979-01-30 US disclosed