SCHEMBL20762835

SCHEMBL20762835

C=CC(=O)OCCCc1ccc(-c2cc(C(F)(F)F)ccc2-c2ccc(C(F)(F)F)cc2-c2ccc(C(F)(F)F)cc2-c2ccc(CCCOC(=O)C=C)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 1/20 0.43
▸ PSEN2 P49810 1/20 0.43
▸ APH1B Q8WW43 1/20 0.43
▸ NCSTN Q92542 1/20 0.43
▸ APH1A Q96BI3 1/20 0.43
▸ PSENEN Q9NZ42 1/20 0.43
▸ NAAA Q02083 1/20 0.39
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ RXRG P48443 1/20 0.39
▸ TSHR P16473 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ PTGDR2 Q9Y5Y4 6/20 0.37
▸ THRB P10828 2/20 0.36
▸ HDAC1 Q13547 2/20 0.36
▸ HDAC8 Q9BY41 2/20 0.36
▸ CYP19A1 P11511 1/20 0.35
▸ CYP11B1 P15538 1/20 0.35
▸ CYP11B2 P19099 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
SCHEMBL20763399 0.87 TSHR (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20762680 0.86 TSHR (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20763309 0.86 PSEN1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20763291 0.86 PSEN1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20762909 0.84 RXRA (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20762847 0.83 THRB (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20762850 0.82 TSHR (0.40) NAAARXRARXRBRXRGTSHR
SCHEMBL20762908 0.82 PSEN1 (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20763299 0.81 TSHR (0.42) NAAATSHRALDH1A1CYP3A4PTGDR2
SCHEMBL20763235 0.79 TSHR (0.45) NAAARXRARXRBRXRGTSHR

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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