SCHEMBL9717218

SCHEMBL9717218

CCCCCC[C@@H](O)C/C=C\CCCCCC(C(C)=O)C(C(C)=O)(C(C)=O)C(=O)OCC(O)CO.CCCCCC[C@@H](O)C/C=C\CCCCCCCC(=O)OCCCC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.56
FAAH O00519 5/20 0.49
FFAR1 O14842 1/20 0.47
FFAR4 Q5NUL3 1/20 0.47
KDM4E B2RXH2 1/20 0.46
DUSP3 P51452 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 1/20 0.46
LPAR1 Q92633 5/20 0.43
ENPP2 Q13822 2/20 0.43
LPAR4 Q99677 2/20 0.43
LPAR5 Q9H1C0 2/20 0.43
LPAR2 Q9HBW0 2/20 0.43
LPAR3 Q9UBY5 2/20 0.43
CES2 O00748 1/20 0.43
LPAR6 P43657 1/20 0.43
TRPV1 Q8NER1 1/20 0.43
PRKCE Q02156 1/20 0.42
PRKCQ Q04759 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
SCHEMBL27580015 0.92 DGKA (0.51) DGKAFAAHFFAR1FFAR4KDM4E
SCHEMBL629459 0.92 DGKA (0.51) DGKAFAAHFFAR1FFAR4KDM4E
SCHEMBL6464382 0.86 DGKA (0.42) DGKAFAAHFFAR1FFAR4KDM4E
Glycerin SCHEMBL5701746 0.83 DGKA (0.65) DGKAFAAHFFAR1FFAR4KDM4E
SCHEMBL27520657 0.82 DGKA (0.83) DGKAFAAHFFAR1FFAR4KDM4E
SCHEMBL2120988 0.82 DGKA (0.83) DGKAFAAHFFAR1FFAR4KDM4E
SCHEMBL15687 0.82 DGKA (0.83) DGKAFAAHFFAR1FFAR4KDM4E
SCHEMBL2697011 0.82 DGKA (0.83) DGKAFAAHFFAR1FFAR4KDM4E
SCHEMBL28029821 0.81 DGKA (0.81) DGKAFAAHFFAR1FFAR4KDM4E
SCHEMBL512067 0.81 FFAR1 (0.69) DGKAFAAHFFAR1FFAR4LPAR1

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-5173432-A Apparatus and method for measuring the concentration or partial pressure of oxygen THE DOW CHEMICAL COMPANY (US) 1992-12-22 US disclosed
US-4994396-A Method for measuring the concentration or partial pressure of oxygen THE DOW CHEMICAL COMPANY (US) 1991-02-19 US disclosed