SCHEMBL7548790

SCHEMBL7548790

CC(=O)Nc1ccc(OCc2nc3cc(F)ccc3s2)cc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 10/20 0.59
EPHX2 P34913 9/20 0.59
NPC1 O15118 3/20 0.57
RAB9A P51151 3/20 0.57
MAPT P10636 3/20 0.57
KMT2A Q03164 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
ALDH1A1 P00352 2/20 0.57
MEN1 O00255 1/20 0.57
DYRK1A Q13627 2/20 0.56
KDM4E B2RXH2 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
PTGER4 P35408 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL7546710 0.91 MAPT (0.57) ALOX5EPHX2NPC1RAB9AMAPT
SCHEMBL7546622 0.90 ALOX5 (0.58) ALOX5EPHX2NPC1RAB9AMAPT
SCHEMBL7551726 0.89 MAPT (0.60) ALOX5EPHX2NPC1RAB9AMAPT
SCHEMBL7541248 0.88 MAPT (0.55) ALOX5EPHX2NPC1RAB9AMAPT
SCHEMBL7548568 0.88 NPC1 (0.61) ALOX5EPHX2NPC1RAB9AMAPT
SCHEMBL7543452 0.88 NPC1 (0.58) ALOX5EPHX2NPC1RAB9AMAPT
SCHEMBL7541638 0.87 NPC1 (0.61) ALOX5EPHX2NPC1RAB9AMAPT
SCHEMBL7551585 0.87 ALOX5 (0.57) ALOX5EPHX2NPC1RAB9AMAPT
SCHEMBL7543869 0.87 MAPT (0.58) ALOX5EPHX2NPC1RAB9AMAPT
SCHEMBL7541432 0.87 EPHX2 (0.65) ALOX5EPHX2NPC1RAB9AMAPT

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