SCHEMBL17577134

SCHEMBL17577134

C=CC(=O)OCc1ccccc1-c1c2ccccc2c(-c2ccccc2COC(=O)C=C)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.43
THRA P10827 1/20 0.37
TYMS P04818 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
TSHR P16473 5/20 0.34
ALDH1A1 P00352 3/20 0.34
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
CYP3A4 P08684 2/20 0.34
HSD17B10 Q99714 1/20 0.34
TGM2 P21980 1/20 0.34
LMNA P02545 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
FABP7 O15540 1/20 0.33
FABP3 P05413 1/20 0.33
FABP5 Q01469 1/20 0.33
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL17577149 0.89 HCAR2 (0.38) THRBHCAR2ALDH1A1TGM2LMNA
SCHEMBL29577996 0.83 THRB (0.53) THRBTHRAHCAR2TSHRALDH1A1
SCHEMBL10451653 0.83 THRB (0.53) THRBTHRAHCAR2TSHRALDH1A1
SCHEMBL8692638 0.83 THRB (0.47) THRBHCAR2TSHRFABP7FABP3
SCHEMBL27421526 0.82 THRB (0.45) THRBTHRATYMSHCAR2TSHR
SCHEMBL29484778 0.79 MEN1 (0.51) THRBALDH1A1TGM2NPSR1NPC1
SCHEMBL2167443 0.79 MEN1 (0.51) THRBALDH1A1TGM2NPSR1NPC1
SCHEMBL25403889 0.78 THRB (0.43) THRBHCAR2TSHRALDH1A1LMNA
SCHEMBL960201 0.77 IDO1 (0.48) THRBTHRAHCAR2TSHRALDH1A1
SCHEMBL9555275 0.77 THRB (0.47) THRBTHRAHCAR2TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9594318-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2017-03-14 US disclosed
US-20160070184-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2016-03-10 US disclosed