SCHEMBL16625916

SCHEMBL16625916

C=CC(=O)OCc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.45
LMNA P02545 1/20 0.43
THRB P10828 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
ENPP2 Q13822 2/20 0.41
ALDH1A1 P00352 4/20 0.40
AKR1B10 O60218 2/20 0.40
AKR1B1 P15121 2/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
CA12 O43570 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
EPHX1 P07099 1/20 0.39

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
SCHEMBL13777455 1.00 HCAR2 (0.45) HCAR2LMNATHRBNPC1RAB9A
SCHEMBL16625920 1.00 HCAR2 (0.45) HCAR2LMNATHRBNPC1RAB9A
SCHEMBL12534114 1.00 HCAR2 (0.45) HCAR2LMNATHRBNPC1RAB9A
SCHEMBL9915733 0.99 HCAR2 (0.44) HCAR2LMNATHRBNPC1RAB9A
SCHEMBL13778858 0.97 HCAR2 (0.45) HCAR2LMNATHRBNPC1RAB9A
SCHEMBL172480 0.97 HCAR2 (0.45) HCAR2LMNATHRBNPC1RAB9A
SCHEMBL2602487 0.96 HCAR2 (0.49) HCAR2LMNATHRBALDH1A1AKR1B10
SCHEMBL2602451 0.96 HCAR2 (0.49) HCAR2LMNATHRBALDH1A1AKR1B10
SCHEMBL12255590 0.94 THRB (0.41) HCAR2LMNATHRBNPC1RAB9A
SCHEMBL12727904 0.94 MMP12 (0.43) HCAR2LMNATHRBNPC1RAB9A

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-9500967-B2 Electrophotographic photosensitive member, method for producing the same, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2016-11-22 US disclosed
US-20150099218-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, METHOD FOR PRODUCING THE SAME, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2015-04-09 US disclosed