SCHEMBL20763229

SCHEMBL20763229

C=CC(=O)OCCCCCc1ccc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 9/20 0.48
▸ RXRG P48443 9/20 0.48
▸ RXRB P28702 8/20 0.48
▸ TSHR P16473 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ NAAA Q02083 1/20 0.43
▸ THRB P10828 3/20 0.40
▸ BACE1 P56817 1/20 0.40
▸ BACE2 Q9Y5Z0 1/20 0.40
▸ GBA1 P04062 1/20 0.38
▸ UGCG Q16739 1/20 0.38
▸ GBA2 Q9HCG7 1/20 0.38
▸ HDAC1 Q13547 2/20 0.38
▸ HDAC8 Q9BY41 2/20 0.38
▸ HPGD P15428 1/20 0.36
▸ SLC13A5 Q86YT5 1/20 0.36
▸ THRA P10827 1/20 0.36

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
SCHEMBL20763235 0.98 TSHR (0.45) RXRARXRGRXRBTSHRALDH1A1
SCHEMBL20763298 0.90 RXRA (0.45) RXRARXRGRXRBNAAATHRB
SCHEMBL20763289 0.87 RXRA (0.43) RXRARXRGRXRBTSHRALDH1A1
SCHEMBL13506252 0.86 TSHR (0.61) TSHRALDH1A1CYP3A4THRBHDAC1
SCHEMBL21242530 0.86 TSHR (0.61) TSHRALDH1A1CYP3A4THRBHDAC1
SCHEMBL21242234 0.86 TSHR (0.61) TSHRALDH1A1CYP3A4THRBHDAC1
SCHEMBL20763309 0.85 PSEN1 (0.41) RXRARXRGRXRBTSHRALDH1A1
SCHEMBL20763291 0.85 PSEN1 (0.41) RXRARXRGRXRBTSHRALDH1A1
SCHEMBL20762847 0.85 THRB (0.40) RXRARXRGRXRBTSHRALDH1A1
SCHEMBL21242266 0.85 TSHR (0.59) TSHRALDH1A1CYP3A4THRBHDAC1

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-20190056676-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, AND ELECTROPHOTOGRAPHIC APPARATUS AND PROCESS CARTRIDGE EACH INCLUDING THE ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER CANON KABUSHIKI KAISHA (JP) 2019-02-21 — — US disclosed
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