SCHEMBL7548682

SCHEMBL7548682

CC(=O)Nc1ccc(OCc2nc3ccccc3o2)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.52
PDE10A Q9Y233 1/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
ALOX5AP P20292 1/20 0.45
TP53 P04637 1/20 0.45
ALOX5 P09917 3/20 0.43
EPHX2 P34913 2/20 0.43
NPC1 O15118 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
AGPAT2 O15120 1/20 0.41
GSTP1 P09211 1/20 0.41
MOK Q9UQ07 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL7545865 0.91 AGPAT2 (0.49) RAB9APDE10AALOX5APTP53ALOX5
SCHEMBL7542425 0.88 ALOX5 (0.48) RAB9APDE10AMAOAMAOBALOX5AP
SCHEMBL7545585 0.87 MAPK13 (0.46) RAB9APDE10AMAOAMAOBALOX5AP
SCHEMBL7547292 0.86 MAPT (0.52) RAB9APDE10ATP53NPC1MEN1
SCHEMBL7548857 0.85 PDE10A (0.44) RAB9APDE10AMAOAMAOBALOX5AP
SCHEMBL7544961 0.84 RAB9A (0.47) RAB9APDE10ANPC1MEN1KMT2A
SCHEMBL7547340 0.82 MEN1 (0.60) RAB9APDE10ANPC1MEN1KMT2A
SCHEMBL7541140 0.79 LMNA (0.53) RAB9AMAOAMAOBALOX5EPHX2
SCHEMBL7545416 0.79 RORC (0.55) RAB9ATP53NPC1MEN1KMT2A
SCHEMBL7541413 0.79 LMNA (0.47) RAB9APDE10AALOX5APTP53ALOX5

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