SCHEMBL7544263

SCHEMBL7544263

Nc1ccc(OCc2nc3cc(F)ccc3s2)cc1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.63
RAB9A P51151 3/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
KMT2A Q03164 1/20 0.63
L3MBTL1 Q9Y468 2/20 0.50
MAPK1 P28482 1/20 0.50
MAPT P10636 2/20 0.49
HTT P42858 1/20 0.49
ALOX5 P09917 6/20 0.48
MAOB P27338 4/20 0.48
PTGER4 P35408 1/20 0.48
PDE10A Q9Y233 1/20 0.45
EPHX2 P34913 3/20 0.44
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYSLTR2 Q9NS75 4/20 0.42
CYSLTR1 Q9Y271 4/20 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
SCHEMBL9335208 0.86 NPC1 (0.55) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL9335573 0.84 SMN1; SMN2 (0.60) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL7545039 0.81 NPC1 (0.56) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL7541252 0.80 NPC1 (0.77) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL9339099 0.80 NPC1 (0.54) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL6636319 0.79 CYP3A4 (0.52) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL7551726 0.78 MAPT (0.60) NPC1RAB9ASMN1; SMN2KMT2AMAPT
SCHEMBL7548790 0.78 ALOX5 (0.59) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL9754811 0.78 NPC1 (0.55) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL7546622 0.78 ALOX5 (0.58) NPC1RAB9ASMN1; SMN2KMT2AMAPK1

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