SCHEMBL19738373

SCHEMBL19738373

C=CC(=O)OCCCc1ccc(-c2cccc(-c3cc(CCOC(=O)C=C)cc(-c4cccc(-c5ccc(C=C)cc5)c4)c3)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1B10 O60218 6/20 0.41
▸ AKR1B1 P15121 6/20 0.41
▸ MET P08581 5/20 0.38
▸ CA12 O43570 2/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA4 P22748 2/20 0.38
▸ CA6 P23280 2/20 0.38
▸ CA5A P35218 2/20 0.38
▸ CA7 P43166 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ CA14 Q9ULX7 2/20 0.38
▸ CA5B Q9Y2D0 2/20 0.38
▸ MGLL Q99685 1/20 0.38
▸ THRB P10828 2/20 0.38
▸ CYP3A4 P08684 3/20 0.37
▸ ALOX15 P16050 2/20 0.37
▸ ALOX12 P18054 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37

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
SCHEMBL19738430 0.97 AKR1B10 (0.42) AKR1B10AKR1B1METCA12CA1
SCHEMBL19738284 0.95 MET (0.41) AKR1B10AKR1B1METCA12CA1
SCHEMBL19738194 0.94 AKR1B10 (0.44) AKR1B10AKR1B1METCA12CA1
SCHEMBL19738421 0.94 AKR1B10 (0.44) AKR1B10AKR1B1METCA12CA1
SCHEMBL19738381 0.94 AKR1B10 (0.44) AKR1B10AKR1B1METCA12CA1
SCHEMBL19738423 0.92 THRB (0.42) AKR1B10AKR1B1METCA12CA1
SCHEMBL19738415 0.92 CA12 (0.44) AKR1B10AKR1B1METCA12CA1
SCHEMBL19730225 0.91 AKR1B1 (0.42) AKR1B10AKR1B1METCA12CA1
SCHEMBL19738429 0.89 THRB (0.43) AKR1B10AKR1B1METTHRBTSHR
SCHEMBL19730223 0.89 AKR1B1 (0.43) AKR1B10AKR1B1CA12CA1CA4

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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