SCHEMBL17577149

SCHEMBL17577149

C=CC(=O)OCc1ccc(-c2c3ccccc3c(-c3ccccc3COC(=O)C=C)c3ccccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.38
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36
FFAR1 O14842 9/20 0.34
FFAR4 Q5NUL3 9/20 0.34
AKR1B10 O60218 2/20 0.34
AKR1B1 P15121 2/20 0.34
CA12 O43570 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
CA5B Q9Y2D0 1/20 0.34
TGM2 P21980 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ENPP2 Q13822 1/20 0.32
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL17577134 0.89 THRB (0.43) HCAR2LMNATHRBFFAR1FFAR4
SCHEMBL19730199 0.81 HCAR2 (0.47) HCAR2LMNATHRBAKR1B10AKR1B1
SCHEMBL17577135 0.78 TSHR (0.45) HCAR2LMNATHRBAKR1B10AKR1B1
SCHEMBL8692638 0.77 THRB (0.47) HCAR2THRBFFAR1FFAR4
SCHEMBL2435314 0.76 HCAR2 (0.53) HCAR2LMNATHRBFFAR1AKR1B10
SCHEMBL19730238 0.76 AKR1B10 (0.48) HCAR2LMNATHRBAKR1B10AKR1B1
SCHEMBL12367978 0.76 HCAR2 (0.46) HCAR2LMNATHRBAKR1B10AKR1B1
SCHEMBL16125662 0.76 HCAR2 (0.46) HCAR2LMNATHRBAKR1B10AKR1B1
SCHEMBL17577127 0.75 HCAR2 (0.42) HCAR2LMNATHRBFFAR1FFAR4
SCHEMBL17577122 0.75 AKR1B10 (0.40) HCAR2LMNATHRBAKR1B10AKR1B1

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