SCHEMBL7548069

SCHEMBL7548069

CC(=O)Nc1ccc(OCc2nc3cc(F)ccc3s2)cc1C

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 10/20 0.62
EPHX2 P34913 7/20 0.62
ALOX5AP P20292 1/20 0.57
DYRK1A Q13627 2/20 0.52
PTGER4 P35408 1/20 0.50
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MAPT P10636 2/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CYSLTR2 Q9NS75 3/20 0.44
CYSLTR1 Q9Y271 3/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 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
SCHEMBL7545175 0.92 ALOX5 (0.60) ALOX5EPHX2ALOX5APDYRK1APTGER4
SCHEMBL7541777 0.91 ALOX5 (0.61) ALOX5EPHX2ALOX5APDYRK1APTGER4
SCHEMBL7548333 0.90 ALOX5 (0.62) ALOX5EPHX2ALOX5APDYRK1ANPC1
SCHEMBL7541360 0.89 ALOX5 (0.57) ALOX5EPHX2ALOX5APDYRK1APTGER4
SCHEMBL7542041 0.89 DYRK1A (0.51) ALOX5EPHX2ALOX5APDYRK1APTGER4
SCHEMBL7544391 0.89 ALOX5 (0.61) ALOX5EPHX2ALOX5APDYRK1ANPC1
SCHEMBL7541784 0.89 ALOX5 (0.58) ALOX5EPHX2ALOX5APDYRK1ANPC1
SCHEMBL7547564 0.88 SMN1; SMN2 (0.50) ALOX5EPHX2ALOX5APDYRK1APTGER4
SCHEMBL7550234 0.88 ALOX5 (0.57) ALOX5EPHX2ALOX5APDYRK1ANPC1
SCHEMBL7545407 0.88 EPHX2 (0.66) ALOX5EPHX2ALOX5APNPC1RAB9A

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