SCHEMBL7549484

SCHEMBL7549484

CC(=O)Nc1ccc(OCc2nc3cc(F)c(F)cc3s2)c(C)c1C

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 12/20 0.43
ALOX5 P09917 11/20 0.43
NPC1 O15118 2/20 0.39
LDHA P00338 1/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DYRK1A Q13627 2/20 0.37
PDPK1 O15530 1/20 0.37
ALOX5AP P20292 1/20 0.37

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
SCHEMBL7541645 0.89 DYRK1A (0.52) EPHX2ALOX5NPC1LDHARAB9A
SCHEMBL7544351 0.89 DYRK1A (0.52) EPHX2ALOX5NPC1RAB9ADYRK1A
SCHEMBL7544292 0.86 DYRK1A (0.52) EPHX2ALOX5NPC1LDHARAB9A
SCHEMBL7550271 0.86 DYRK1A (0.52) EPHX2ALOX5NPC1RAB9AMEN1
SCHEMBL7550288 0.84 EPHX2 (0.52) EPHX2ALOX5SMN1; SMN2DYRK1AALOX5AP
SCHEMBL7541020 0.84 DYRK1A (0.54) EPHX2ALOX5DYRK1A
SCHEMBL7550313 0.84 NPC1 (0.58) EPHX2ALOX5NPC1RAB9AMEN1
SCHEMBL7548621 0.84 DYRK1A (0.55) EPHX2ALOX5NPC1RAB9AMAPT
SCHEMBL7541627 0.84 NPC1 (0.55) EPHX2ALOX5NPC1RAB9AMEN1
SCHEMBL7541784 0.83 ALOX5 (0.58) EPHX2ALOX5NPC1RAB9AMEN1

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