SCHEMBL8848825

SCHEMBL8848825

CCCCCCCCCCCCCCCCC(CC(C)C)(C(=O)O)[N+](=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
CES2 O00748 4/20 0.34
PPARG P37231 7/20 0.33
CES1 P23141 3/20 0.33
PPARA Q07869 2/20 0.33
PLA2G2A P14555 2/20 0.33
PLA2G5 P39877 2/20 0.33
ACE2 Q9BYF1 1/20 0.33
TRPA1 O75762 1/20 0.33
FBP1 P09467 1/20 0.33

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
SCHEMBL7689221 0.71 ALDH1A1 (0.39) ALDH1A1CES2PPARGCES1PPARA
SCHEMBL11908045 0.70 CES2 (0.38) ALDH1A1CES2PPARGPPARAACE2
SCHEMBL5488283 0.69 ALDH1A1 (0.38) ALDH1A1CES2PPARGCES1PPARA
SCHEMBL18050601 0.69 CES2 (0.36) ALDH1A1CES2PPARGPPARAACE2
SCHEMBL6054905 0.69 GAA (0.41) CES2
SCHEMBL13518021 0.69 AKR1B1 (0.33) ALDH1A1ACE2
SCHEMBL28009580 0.66 ARG1 (0.64) CES2
SCHEMBL8882093 0.66 ACE2 (0.43) CES2ACE2
SCHEMBL10565384 0.66 SMPD1 (0.44) ALDH1A1CES2PPARGPPARAACE2
SCHEMBL13519426 0.66 ACE2 (0.32) ALDH1A1ACE2

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
EP-0412606-B1 UV-stabilization of polymers using nitro compounds AKZO NOBEL NV (NL) 1997-01-15 EP disclosed
US-5122555-A Mixing with polyolefin and conventional stabilizer AKZO NV (NL) 1992-06-16 US disclosed
EP-0412606-A1 UV-stabilization of polymers using nitro compounds Akzo Nobel N.V. (NL) 1991-02-13 EP disclosed