SCHEMBL7548776

SCHEMBL7548776

COC(=O)Nc1ccc(OCc2nc3cc(Cl)cc(Cl)c3o2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.46
CETP P11597 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
AGPAT2 O15120 5/20 0.44
POLB P06746 2/20 0.44
GAA P10253 2/20 0.44
ALOX5 P09917 1/20 0.40
EPHX2 P34913 1/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL7541091 0.86 ALOX5 (0.44) MAPTCETPAGPAT2ALOX5EPHX2
SCHEMBL7543732 0.84 AGPAT2 (0.58) MAPTCETPSMN1; SMN2NPC1RAB9A
SCHEMBL7543927 0.82 MAPT (0.56) MAPTCETPSMN1; SMN2NPC1RAB9A
SCHEMBL7547594 0.80 SMN1; SMN2 (0.47) MAPTSMN1; SMN2NPC1RAB9APOLB
SCHEMBL7544432 0.78 ALOX5 (0.44) MAPTCETPSMN1; SMN2POLBGAA
SCHEMBL7542905 0.77 SMN1; SMN2 (0.50) MAPTSMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL7550212 0.77 RAB9A (0.51) MAPTCETPSMN1; SMN2NPC1RAB9A
SCHEMBL8666294 0.77 SMN1; SMN2 (0.49) MAPTCETPSMN1; SMN2NPC1RAB9A
SCHEMBL7542952 0.77 SMN1; SMN2 (0.57) MAPTSMN1; SMN2NPC1RAB9AAGPAT2
SCHEMBL7542964 0.76 MAPT (0.56) MAPTCETPSMN1; SMN2NPC1RAB9A

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