SCHEMBL17577137

SCHEMBL17577137

C=CC(=O)OCCCCCc1ccc(-c2cc(-c3ccc(COC(=O)C=C)cc3)c3ccc4cc(C(C)(C)C)cc5ccc2c3c54)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.36
TSHR P16473 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
RARB P10826 2/20 0.31
TGM2 P21980 1/20 0.31
MET P08581 2/20 0.31
AKR1B10 O60218 1/20 0.31
AKR1B1 P15121 1/20 0.31
THRA P10827 3/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL17577123 0.96 THRB (0.35) THRBTSHRALDH1A1CYP3A4RXRA
SCHEMBL17577163 0.90 THRB (0.35) THRBTSHRALDH1A1CYP3A4RXRA
SCHEMBL17577126 0.90 RARB (0.36) THRBTSHRALDH1A1CYP3A4RXRA
SCHEMBL17577164 0.90 THRB (0.35) THRBTSHRALDH1A1CYP3A4RXRA
SCHEMBL17578281 0.89 THRB (0.35) THRBTSHRALDH1A1CYP3A4RARB
SCHEMBL17577141 0.89 TSHR (0.43) THRBTSHRALDH1A1CYP3A4RARB
SCHEMBL17578277 0.88 MET (0.35) THRBTSHRRXRARXRBRXRG
SCHEMBL17577199 0.88 TSHR (0.32) THRBTSHRALDH1A1CYP3A4MET
SCHEMBL17577160 0.88 THRB (0.42) THRBTSHRALDH1A1CYP3A4RXRA
SCHEMBL17577166 0.87 THRB (0.33) THRBTSHRALDH1A1CYP3A4RARB

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