SCHEMBL10338271

SCHEMBL10338271

CCCCCCCCCCCCNC(CC(=O)O)C(=O)OC(C)CCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.50
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
GPR84 Q9NQS5 4/20 0.44
ALDH1A1 P00352 1/20 0.42
NAAA Q02083 1/20 0.39
ZDHHC7 Q9NXF8 1/20 0.39
NOD1 Q9Y239 1/20 0.38

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
SCHEMBL28723322 0.88 FAAH (0.49) FAAHCNR1CNR2GPR84ALDH1A1
SCHEMBL5359786 0.77 EPHX2 (0.35) FAAHGPR84NOD1
SCHEMBL28301605 0.77 FAAH (0.52) FAAHCNR1CNR2GPR84ALDH1A1
SCHEMBL1990411 0.77 EPHX2 (0.50) GPR84ALDH1A1NOD1
SCHEMBL7626586 0.77 EPHX2 (0.50) GPR84ALDH1A1NOD1
SCHEMBL29208288 0.77 EPHX2 (0.50) GPR84ALDH1A1NOD1
SCHEMBL6001495 0.77 EPHX2 (0.50) GPR84ALDH1A1NOD1
SCHEMBL7572383 0.77 EPHX2 (0.50) GPR84ALDH1A1NOD1
SCHEMBL29690808 0.77 EPHX2 (0.50) GPR84ALDH1A1NOD1
SCHEMBL5154832 0.77 EPHX2 (0.50) GPR84ALDH1A1NOD1

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
JP-2043256-A None JP disclosed
JP-H0243256-A POLYPHENYLENE ETHER COMPOSITION MITSUI TOATSU CHEM INC 1990-02-13 JP disclosed