SCHEMBL7542386

SCHEMBL7542386

COC(=O)N(C(=O)c1ccc(C)cc1)c1ccc(OCc2nc3ccccc3s2)cc1C

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 11/20 0.54
EPHX2 P34913 11/20 0.54
MAPT P10636 4/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
HTT P42858 1/20 0.53
ALOX5AP P20292 1/20 0.49
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
MAPK1 P28482 1/20 0.44

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
SCHEMBL7548146 0.95 ALOX5 (0.54) ALOX5EPHX2MAPTNPC1RAB9A
SCHEMBL7544269 0.95 ALOX5 (0.58) ALOX5EPHX2MAPTNPC1RAB9A
SCHEMBL7544340 0.93 EPHX2 (0.60) ALOX5EPHX2MAPTNPC1RAB9A
SCHEMBL7541496 0.91 ALOX5 (0.51) ALOX5EPHX2MAPTNPC1RAB9A
SCHEMBL7548666 0.91 NPC1 (0.61) ALOX5EPHX2MAPTNPC1RAB9A
SCHEMBL7544833 0.90 ALOX5 (0.59) ALOX5EPHX2MAPTNPC1RAB9A
SCHEMBL8668195 0.89 NPC1 (0.53) ALOX5EPHX2MAPTNPC1RAB9A
SCHEMBL7541445 0.89 ALOX5 (0.51) ALOX5EPHX2MAPTNPC1RAB9A
SCHEMBL7545580 0.88 ALOX5 (0.54) ALOX5EPHX2MAPTNPC1RAB9A
SCHEMBL7547550 0.88 EPHX2 (0.59) ALOX5EPHX2MAPTNPC1RAB9A

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