SCHEMBL2387072

SCHEMBL2387072

CCCCCCCCC=CCCCCCCCCOc1ccc(CCOC(=O)CCCCCCCC=CCCCCCCCC)cc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.55
MGLL Q99685 1/20 0.53
DGKA P23743 2/20 0.53
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
THRB P10828 1/20 0.52
S1PR4 O95977 2/20 0.50
S1PR1 P21453 2/20 0.50
S1PR3 Q99500 2/20 0.50
EPHX2 P34913 1/20 0.49
S1PR5 Q9H228 1/20 0.48

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
SCHEMBL2387062 1.00 CNR1 (0.55) CNR1MGLLDGKAALDH1A1MAPT
SCHEMBL2386450 0.92 DGKA (0.62) DGKAALDH1A1S1PR4S1PR1S1PR3
SCHEMBL2387070 0.91 CNR1 (0.54) CNR1MGLLDGKAALDH1A1MAPT
SCHEMBL2385815 0.89 MGLL (0.54) CNR1MGLLDGKAALDH1A1MAPT
SCHEMBL2385809 0.89 MGLL (0.54) CNR1MGLLDGKAALDH1A1MAPT
SCHEMBL21753482 0.87 EPHX2 (0.59) CNR1MGLLDGKAALDH1A1MAPT
SCHEMBL2383925 0.86 TRPV1 (0.51) CNR1MGLLDGKAALDH1A1MAPT
SCHEMBL2383933 0.86 TRPV1 (0.51) CNR1MGLLDGKAALDH1A1MAPT
SCHEMBL1316201 0.85 MGLL (0.56) CNR1MGLLDGKAALDH1A1MAPT
SCHEMBL1316198 0.85 MGLL (0.56) CNR1MGLLDGKAALDH1A1MAPT

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
US-8465939-B2 Aging-related circulating particle-associated lipoprotein B oxidase (apoBNOX) and inhibitors thereof NOX TECHNOLOGIES, INC. (US) 2013-06-18 US disclosed
US-20110217401-A1 Aging-Related Circulating Particle-Associated Lipoprotein B Oxidase (apoBNOX) and Inhibitors Thereof NOX TECHNOLOGIES, INC. 2011-09-08 US disclosed