SCHEMBL17708232

SCHEMBL17708232

C=CC(=O)Oc1cc(C)c(OC(=O)C=C)cc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.42
THRA P10827 1/20 0.41
TYMS P04818 1/20 0.36
ACHE P22303 2/20 0.34
TSHR P16473 5/20 0.33
HTT P42858 1/20 0.33
HIF1A Q16665 2/20 0.33
CYP1A2 P05177 1/20 0.33
ADRA2A P08913 1/20 0.33
CYP2D6 P10635 1/20 0.33
PKM P14618 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
ADRA1D P25100 1/20 0.33
HTR2C P28335 1/20 0.33
ADRA1A P35348 1/20 0.33
HRH1 P35367 1/20 0.33
ADRA1B P35368 1/20 0.33
DRD3 P35462 1/20 0.33
OPRK1 P41145 1/20 0.33

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
SCHEMBL13048604 0.96 THRB (0.40) THRBTHRATYMSACHETSHR
SCHEMBL14173231 0.94 THRB (0.39) THRBTHRATYMSACHETSHR
SCHEMBL13048704 0.85 THRB (0.34) THRBTHRATYMSHTTSMN1; SMN2
SCHEMBL17842625 0.84 POLB (0.38) THRBTHRATYMSTSHRHTT
SCHEMBL27464291 0.83 TSHR (0.46) THRBTHRAACHETSHRHTT
SCHEMBL39820 0.83 L3MBTL1 (0.47) THRBTHRATYMSCYP1A2HPGD
SCHEMBL30593911 0.83 L3MBTL1 (0.47) THRBTHRATYMSCYP1A2HPGD
SCHEMBL1696567 0.83 THRB (0.47) THRBTHRATYMSACHESMN1; SMN2
SCHEMBL16921467 0.82 THRB (0.44) THRBTHRATSHRHTTSMN1; SMN2
SCHEMBL26041846 0.80 THRB (0.38) THRBTHRATYMSACHETSHR

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-9760030-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2017-09-12 US disclosed
US-20160116853-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2016-04-28 US disclosed