SCHEMBL28176014

SCHEMBL28176014

CCCCOCC=C(C)C(=O)NOC

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
CES2 O00748 1/20 0.36
ATM Q13315 1/20 0.34
LSS P48449 1/20 0.34
APEX1 P27695 1/20 0.34
TSHR P16473 2/20 0.33
MAPT P10636 2/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.32
PLA2G2C Q5R387 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL3672318 0.80 ALDH1A1 (0.41) ALDH1A1CES2ATMLSSTSHR
SCHEMBL454527 0.80 ALDH1A1 (0.41) ALDH1A1CES2ATMLSSTSHR
SCHEMBL28088529 0.80 CCR2 (0.37) ALDH1A1APEX1TSHRZDHHC7
SCHEMBL28176030 0.79 ALDH1A1 (0.35) ALDH1A1CES2ATMLSSTSHR
SCHEMBL213672 0.78 ALDH1A1 (0.42) ALDH1A1CES2ATMLSSTSHR
SCHEMBL10349293 0.75 ALDH1A1 (0.32) ALDH1A1APEX1
SCHEMBL7776375 0.73 CES2 (0.50) CES2LSSTSHRMAPTPLA2G2C
SCHEMBL28550746 0.72 ALDH1A1 (0.37) ALDH1A1CES2ATMLSSTSHR
SCHEMBL1684993 0.71 CES2 (0.52) CES2LSSTSHRMAPTPLA2G2C
SCHEMBL21694736 0.71 ALDH1A1 (0.39) ALDH1A1CES2ATMTSHRMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106167634-B Metal oxide composition, its cured film and the component with the cured film 东洋油墨SC控股株式会社 2018-04-27 CN disclosed
CN-105074978-B Conductive composition, electrical storage device collector, electrode for power storage device and electrical storage device with basalis 东洋油墨SC控股株式会社 2017-09-22 CN disclosed
CN-105144435-B Conductive composition, basalis formation conductive composition, collector, electrode for power storage device and electrical storage device of the electrical storage device with basalis 东洋油墨SC控股株式会社 2017-09-12 CN disclosed