SCHEMBL7542358

SCHEMBL7542358

COC(=O)Nc1ccc(OCc2nc3cc(C)ccc3s2)cc1C

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 11/20 0.62
EPHX2 P34913 11/20 0.62
ALOX5AP P20292 1/20 0.56
NPC1 O15118 2/20 0.48
MAPT P10636 2/20 0.48
RAB9A P51151 2/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
DYRK1A Q13627 1/20 0.44
TRPV1 Q8NER1 1/20 0.43
HPGD P15428 1/20 0.42
LMNA P02545 1/20 0.42
PPARD Q03181 1/20 0.42

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
SCHEMBL7545438 0.93 ALOX5 (0.61) ALOX5EPHX2ALOX5APNPC1MAPT
SCHEMBL7545138 0.92 ALOX5 (0.62) ALOX5EPHX2ALOX5APNPC1MAPT
SCHEMBL7548333 0.92 ALOX5 (0.62) ALOX5EPHX2ALOX5APNPC1MAPT
SCHEMBL7546650 0.91 EPHX2 (0.65) ALOX5EPHX2ALOX5APNPC1MAPT
SCHEMBL7541777 0.91 ALOX5 (0.61) ALOX5EPHX2ALOX5APNPC1MAPT
SCHEMBL7542390 0.89 ALOX5 (0.76) ALOX5EPHX2ALOX5APNPC1MAPT
SCHEMBL7542575 0.88 ALOX5 (0.56) ALOX5EPHX2ALOX5APNPC1MAPT
SCHEMBL7543961 0.86 ALOX5 (0.61) ALOX5EPHX2ALOX5APNPC1MAPT
SCHEMBL7544259 0.85 EPHX2 (0.65) ALOX5EPHX2ALOX5APNPC1MAPT
SCHEMBL7544370 0.85 ALOX5 (0.59) ALOX5EPHX2ALOX5APNPC1MAPT

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