SCHEMBL8669849

SCHEMBL8669849

CC(OC(C(N)=O)c1ccccc1)c1nc2ccccc2s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.53
RAB9A P51151 2/20 0.52
HPGD P15428 3/20 0.51
LOXL2 Q9Y4K0 1/20 0.47
CYP1A2 P05177 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP2C9 P11712 1/20 0.45
HIF1A Q16665 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TSHR P16473 2/20 0.44
GAA P10253 2/20 0.44
MAPK1 P28482 1/20 0.44
ALOX15 P16050 1/20 0.44
CASP1 P29466 1/20 0.44
PKM P14618 1/20 0.42
CSNK1D P48730 2/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 2/20 0.41
OPRK1 P41145 1/20 0.41
NCS1 P62166 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
SCHEMBL8674242 0.88 ALOX5 (0.51) ALOX5RAB9AHPGDLOXL2CYP1A2
SCHEMBL8669504 0.84 HPGD (0.48) ALOX5RAB9AHPGDLOXL2CYP1A2
SCHEMBL11585822 0.77 HPGD (0.60) ALOX5RAB9AHPGDLOXL2CYP1A2
SCHEMBL11587666 0.77 ALOX5 (0.65) ALOX5RAB9AHPGDLOXL2CYP1A2
SCHEMBL4561510 0.76 HCAR2 (0.45) ALOX5CYP1A2HIF1APKMALDH1A1
SCHEMBL27443616 0.75 ALOX5 (0.53) ALOX5RAB9AHPGDLOXL2CYP1A2
SCHEMBL11697365 0.75 HPGD (0.60) ALOX5RAB9AHPGDLOXL2CYP1A2
SCHEMBL8672785 0.74 CASR (0.43) ALOX5HPGDCYP1A2CYP2C19TSHR
SCHEMBL3963337 0.72 HPGD (0.60) ALOX5RAB9AHPGDLOXL2CYP1A2
SCHEMBL22997080 0.72 HPGD (0.65) ALOX5RAB9AHPGDLOXL2CYP1A2

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