SCHEMBL21585282

SCHEMBL21585282

CCCCCCCC/C=C\CCCCCCCC1=NC(C(=O)OCC)CO1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.43
FAAH O00519 2/20 0.42
PPARA Q07869 2/20 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
SCHEMBL21585290 1.00 EPHX2 (0.43) EPHX2FAAHPPARA
SCHEMBL23409164 0.86 EPHX2 (0.47) EPHX2PPARA
SCHEMBL21582229 0.85 EPHX2 (0.44) EPHX2FAAHPPARA
SCHEMBL23391370 0.82 ALDH1A1 (0.46) EPHX2PPARA
SCHEMBL23391367 0.82 ALDH1A1 (0.46) EPHX2PPARA
SCHEMBL15201102 0.81 EPHX2 (0.39) EPHX2
SCHEMBL2150944 0.75 EPHX2 (0.41) EPHX2FAAH
SCHEMBL2150947 0.75 EPHX2 (0.41) EPHX2FAAH
Oleic Acid SCHEMBL11315757 0.72 PPARG (0.52) EPHX2FAAHPPARA
Oleic Acid SCHEMBL11315759 0.72 PPARG (0.52) EPHX2FAAHPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019228994-A1 OLEIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITION OR FOOD COMPOSITION COMPRISING SAID OLEIC ACID DERIVATIVES, AND THEIR USES Université de Bourgogne (FR) 2019-12-05 WO disclosed