SCHEMBL19730203

SCHEMBL19730203

C=CC(=O)OCCCc1ccc(-c2cc(CCOC(=O)C=C)cc(-c3ccc(COC(=O)C=C)cc3)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ AKR1B10 O60218 6/20 0.40
▸ AKR1B1 P15121 6/20 0.40
▸ MET P08581 5/20 0.40
▸ THRB P10828 3/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA4 P22748 1/20 0.40
▸ CA6 P23280 1/20 0.40
▸ CA5A P35218 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ CA14 Q9ULX7 1/20 0.40
▸ CA5B Q9Y2D0 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ TP53 P04637 2/20 0.38
▸ HIF1A Q16665 2/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL19730225 0.95 AKR1B1 (0.42) TSHRALDH1A1CYP3A4AKR1B10AKR1B1
SCHEMBL19730223 0.93 AKR1B1 (0.43) TSHRALDH1A1CYP3A4AKR1B10AKR1B1
SCHEMBL19738284 0.90 MET (0.41) TSHRALDH1A1CYP3A4AKR1B10AKR1B1
SCHEMBL19730241 0.90 AKR1B10 (0.45) TSHRALDH1A1CYP3A4AKR1B10AKR1B1
SCHEMBL19730212 0.90 AKR1B10 (0.45) TSHRALDH1A1CYP3A4AKR1B10AKR1B1
SCHEMBL19730245 0.89 THRB (0.49) TSHRALDH1A1CYP3A4AKR1B10AKR1B1
SCHEMBL19730243 0.88 THRB (0.45) TSHRALDH1A1CYP3A4AKR1B10AKR1B1
SCHEMBL19730206 0.88 MET (0.44) TSHRALDH1A1CYP3A4AKR1B10AKR1B1
SCHEMBL19730237 0.87 THRB (0.43) TSHRALDH1A1AKR1B10AKR1B1MET
SCHEMBL19730242 0.87 THRB (0.44) TSHRALDH1A1AKR1B10AKR1B1MET

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-20170364025-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS FOR PRODUCING ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, AND ELECTROPHOTOGRAPHIC APPARATUS AND PROCESS CARTRIDGE INCLUDING ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER CANON KABUSHIKI KAISHA (JP) 2017-12-21 — — US disclosed
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