SCHEMBL7542439

SCHEMBL7542439

CC(=O)Nc1ccc(OCc2nc3cc(Cl)c(C)cc3s2)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 15/20 0.56
ALOX5 P09917 14/20 0.56
L3MBTL1 Q9Y468 1/20 0.53
MEN1 O00255 2/20 0.53
ALDH1A1 P00352 2/20 0.53
MAPT P10636 2/20 0.53
KMT2A Q03164 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
ALOX5AP P20292 1/20 0.52
KDM4E B2RXH2 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
GAA P10253 1/20 0.47
RECQL P46063 1/20 0.47

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
SCHEMBL7543769 0.88 ALOX5 (0.55) EPHX2ALOX5L3MBTL1MEN1ALDH1A1
SCHEMBL7550178 0.88 EPHX2 (0.54) EPHX2ALOX5L3MBTL1MEN1ALDH1A1
SCHEMBL7548209 0.88 EPHX2 (0.63) EPHX2ALOX5L3MBTL1MEN1ALDH1A1
SCHEMBL7545312 0.87 MAPT (0.53) EPHX2ALOX5L3MBTL1MEN1ALDH1A1
SCHEMBL7545045 0.85 MAPT (0.53) EPHX2ALOX5L3MBTL1MEN1ALDH1A1
SCHEMBL7548640 0.85 EPHX2 (0.65) EPHX2ALOX5L3MBTL1MEN1ALDH1A1
SCHEMBL7541432 0.85 EPHX2 (0.65) EPHX2ALOX5L3MBTL1MEN1ALDH1A1
SCHEMBL7543452 0.84 NPC1 (0.58) EPHX2ALOX5L3MBTL1MEN1ALDH1A1
SCHEMBL7541248 0.84 MAPT (0.55) EPHX2ALOX5L3MBTL1MEN1ALDH1A1
SCHEMBL7542768 0.81 MAPT (0.64) EPHX2ALOX5MEN1ALDH1A1MAPT

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 2 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
EP-0795550-A1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO COMPANY LIMITED (JP) 1997-09-17 EP disclosed