SCHEMBL7548540

SCHEMBL7548540

CCc1cc(OCc2nc3cc(Cl)ccc3s2)ccc1NC(C)=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 13/20 0.53
ALOX5 P09917 12/20 0.53
ALOX5AP P20292 1/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
LOXL2 Q9Y4K0 1/20 0.42
TRPV1 Q8NER1 1/20 0.42
DYRK1A Q13627 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
SCHEMBL7551643 0.90 ALOX5 (0.56) EPHX2ALOX5ALOX5APNPC1RAB9A
SCHEMBL7543706 0.89 DYRK1A (0.56) EPHX2ALOX5ALOX5APNPC1RAB9A
SCHEMBL7542633 0.89 ALOX5 (0.50) EPHX2ALOX5ALOX5APNPC1RAB9A
SCHEMBL7545407 0.89 EPHX2 (0.66) EPHX2ALOX5ALOX5APNPC1RAB9A
SCHEMBL7542041 0.88 DYRK1A (0.51) EPHX2ALOX5ALOX5APNPC1RAB9A
SCHEMBL7542457 0.87 ALOX5 (0.62) EPHX2ALOX5ALOX5APNPC1RAB9A
SCHEMBL7542888 0.85 DYRK1A (0.53) EPHX2ALOX5ALOX5APNPC1RAB9A
SCHEMBL7541047 0.85 ALOX5 (0.46) EPHX2ALOX5ALOX5APNPC1RAB9A
SCHEMBL7541432 0.84 EPHX2 (0.65) EPHX2ALOX5ALOX5APNPC1RAB9A
SCHEMBL7551595 0.83 ALOX5 (0.51) EPHX2ALOX5ALOX5APNPC1RAB9A

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