SCHEMBL8665596

SCHEMBL8665596

COC(=O)N(C(=O)c1cnccc1OCc1nc2ccccc2s1)c1ccccc1C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.49
RAB9A P51151 3/20 0.48
EPHX2 P34913 9/20 0.46
ALOX5 P09917 8/20 0.46
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
PKM P14618 1/20 0.45
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL8664004 0.82 ALOX5 (0.54) NPC1RAB9AEPHX2ALOX5MAPT
SCHEMBL8663612 0.82 EPHX2 (0.53) NPC1RAB9AEPHX2ALOX5MAPT
SCHEMBL8664251 0.82 ALOX5 (0.50) NPC1RAB9AEPHX2ALOX5MAPT
SCHEMBL8668195 0.81 NPC1 (0.53) NPC1RAB9AEPHX2ALOX5MAPT
SCHEMBL8665897 0.81 MAPT (0.53) NPC1RAB9AEPHX2ALOX5MAPT
SCHEMBL8668165 0.80 ALOX5 (0.55) NPC1RAB9AEPHX2ALOX5MAPT
SCHEMBL7545580 0.79 ALOX5 (0.54) NPC1RAB9AEPHX2ALOX5MAPT
SCHEMBL8666755 0.78 NPC1 (0.54) NPC1RAB9AEPHX2ALOX5MAPT
SCHEMBL8664403 0.78 EPHX2 (0.47) NPC1RAB9AEPHX2ALOX5MAPT
SCHEMBL8668510 0.78 EPHX2 (0.52) NPC1RAB9AEPHX2ALOX5MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5736487-A HERBICIDES SANKYO COMPANY, LIMITED (JP) 1998-04-07 US disclosed