SCHEMBL6265149

SCHEMBL6265149

CCCCC/C=C\C/C=C\CCCCCCCCC(CCCCCCCC/C=C\C/C=C\CCCCC)(CCCCCCCCCCCCCC)C(=S)OCC(O)CO

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.58
DGKA P23743 1/20 0.54
SELP P16109 1/20 0.44
ALDH1A1 P00352 1/20 0.44
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
KDM4E B2RXH2 1/20 0.42
DUSP3 P51452 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL4890647 0.88 KDM4E (0.51) FAAHDGKACNR2KDM4EDUSP3
SCHEMBL4893171 0.88 KDM4E (0.51) FAAHDGKACNR2KDM4EDUSP3
SCHEMBL4893811 0.88 KDM4E (0.51) FAAHDGKACNR2KDM4EDUSP3
SCHEMBL4892938 0.85 KDM4E (0.47) FAAHDGKACNR2KDM4EDUSP3
SCHEMBL7574622 0.81 DGKA (0.65) FAAHDGKASELPKDM4EDUSP3
Glyceryl Monolinoleate SCHEMBL19564919 0.75 FAAH (0.92) FAAHDGKASELPKDM4EDUSP3
Glyceryl Monolinoleate SCHEMBL154133 0.75 FAAH (0.92) FAAHDGKASELPKDM4EDUSP3
Glyceryl Monolinoleate SCHEMBL4350267 0.75 FAAH (0.92) FAAHDGKASELPKDM4EDUSP3
Glyceryl Monolinoleate SCHEMBL6371582 0.75 FAAH (0.92) FAAHDGKASELPKDM4EDUSP3
SCHEMBL10011646 0.75 FAAH (0.52) FAAHDGKAALDH1A1KDM4EDUSP3

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
EP-1596845-A1 THERAPEUTIC USE OF ACYL GLYCEROLS AND THE NITROGEN- AND SULPHUR-CONTAINING ANALOGUES THEROF Genfit (FR) 2005-11-23 EP disclosed
WO-2004073698-A1 THERAPEUTIC USE OF ACYL GLYCEROLS AND THE NITROGEN- AND SULPHUR-CONTAINING ANALOGUES THEROF GENFIT (FR) 2004-09-02 WO disclosed