SCHEMBL8664251

SCHEMBL8664251

COC(=O)N(C(=O)c1ccc(OCc2nc3ccccc3s2)cc1OC)c1ccccc1C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 10/20 0.50
EPHX2 P34913 10/20 0.50
NPC1 O15118 5/20 0.49
MAPT P10636 4/20 0.49
RAB9A P51151 3/20 0.49
HTT P42858 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
PKM P14618 1/20 0.47
ALDH1A1 P00352 2/20 0.46
KLF5 Q13887 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALOX5AP P20292 1/20 0.46

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 0.92 ALOX5 (0.54) ALOX5EPHX2NPC1MAPTRAB9A
SCHEMBL8668165 0.90 ALOX5 (0.55) ALOX5EPHX2NPC1MAPTRAB9A
SCHEMBL7544490 0.90 ALOX5 (0.52) ALOX5EPHX2NPC1MAPTRAB9A
SCHEMBL7545580 0.87 ALOX5 (0.54) ALOX5EPHX2NPC1MAPTRAB9A
SCHEMBL8668195 0.86 NPC1 (0.53) ALOX5EPHX2NPC1MAPTRAB9A
SCHEMBL8664403 0.84 EPHX2 (0.47) ALOX5EPHX2NPC1MAPTRAB9A
SCHEMBL8665897 0.83 MAPT (0.53) ALOX5EPHX2NPC1MAPTRAB9A
SCHEMBL7548666 0.83 NPC1 (0.61) ALOX5EPHX2NPC1MAPTRAB9A
SCHEMBL7541183 0.83 ALOX5 (0.59) ALOX5EPHX2NPC1MAPTRAB9A
SCHEMBL8666755 0.83 NPC1 (0.54) ALOX5EPHX2NPC1MAPTRAB9A

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