SCHEMBL7541535

SCHEMBL7541535

COCC(=O)Nc1ccc(OCc2nc3ccccc3s2)cc1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.80
NPC1 O15118 5/20 0.80
RAB9A P51151 5/20 0.80
MAPT P10636 4/20 0.80
SMN1; SMN2 Q16637 4/20 0.80
KMT2A Q03164 2/20 0.80
MEN1 O00255 1/20 0.80
ALOX5 P09917 9/20 0.72
EPHX2 P34913 9/20 0.72
KDM4E B2RXH2 1/20 0.70
TDP1 Q9NUW8 1/20 0.70
MAPK1 P28482 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
TP53 P04637 1/20 0.54

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
SCHEMBL7543974 0.89 NPC1 (0.77) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL7541729 0.89 ALDH1A1 (0.80) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL7542600 0.89 NPC1 (1.00) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL7544973 0.87 NPC1 (0.77) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL7540872 0.86 NPC1 (0.79) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL7544458 0.86 NPC1 (0.79) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL8769691 0.85 EPHX2 (0.84) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL11131775 0.85 NPC1 (0.70) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL7541569 0.84 NPC1 (0.76) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL7543728 0.84 EPHX2 (0.78) ALDH1A1NPC1RAB9AMAPTSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795550-B1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO CO (JP) 2002-06-05 EP disclosed
US-5736487-A HERBICIDES SANKYO COMPANY, LIMITED (JP) 1998-04-07 US disclosed
EP-0795550-A1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO COMPANY LIMITED (JP) 1997-09-17 EP disclosed