SCHEMBL17577140

SCHEMBL17577140

C=CC(=O)OCCCc1ccc(-c2cc(CCCCCC)c3ccc4c(-c5ccc(COC(=O)C=C)cc5)cc(-c5ccc(COC(=O)C=C)cc5)c5ccc2c3c45)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 9/20 0.44
THRA P10827 7/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
RARB P10826 10/20 0.38
RARA P10276 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
MTOR P42345 1/20 0.36
RARG P13631 1/20 0.35

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
SCHEMBL17577132 1.00 THRB (0.44) THRBTHRAMEN1KMT2AHPGD
SCHEMBL17578319 0.92 THRB (0.43) THRBTHRAMEN1KMT2AHPGD
SCHEMBL17577141 0.88 TSHR (0.43) THRBTHRAMEN1KMT2AHPGD
SCHEMBL17577169 0.85 TSHR (0.42) THRBTHRAMEN1KMT2ATSHR
SCHEMBL17578320 0.81 TSHR (0.40) THRBTHRAMEN1KMT2ATSHR
SCHEMBL17578321 0.81 THRB (0.40) THRBTHRAMEN1KMT2AHPGD
SCHEMBL17577137 0.80 THRB (0.36) THRBTHRAMEN1KMT2AHPGD
SCHEMBL17577123 0.80 THRB (0.35) THRBHPGDTSHRALDH1A1
SCHEMBL13783930 0.78 THRB (0.68) THRBTHRAMEN1KMT2AHPGD
SCHEMBL15658638 0.78 THRB (0.68) THRBTHRAMEN1KMT2AHPGD

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