SCHEMBL17228577

SCHEMBL17228577

CCCCCCC(O)C/C=C\CCCCCCCC(=O)OCCOCCOC(=O)CCCCCCC/C=C\CC(O)CCCCCC

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.66
FFAR4 Q5NUL3 1/20 0.66
FAAH O00519 4/20 0.58
EPHX2 P34913 1/20 0.58
DGKA P23743 2/20 0.57
LPAR1 Q92633 7/20 0.52
LPAR4 Q99677 3/20 0.52
LPAR2 Q9HBW0 3/20 0.52
LPAR3 Q9UBY5 3/20 0.52
ENPP2 Q13822 2/20 0.52
LPAR5 Q9H1C0 2/20 0.52
CES2 O00748 1/20 0.52
LPAR6 P43657 1/20 0.52
TRPV1 Q8NER1 1/20 0.52
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
MGLL Q99685 1/20 0.50
PRKCE Q02156 1/20 0.49
PRKCQ Q04759 1/20 0.49

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
SCHEMBL3662597 0.98 FFAR1 (0.63) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL26868753 0.96 FFAR1 (0.62) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL26868705 0.96 FFAR1 (0.71) FFAR1FFAR4FAAHDGKALPAR1
SCHEMBL30775153 0.96 FFAR1 (0.71) FFAR1FFAR4FAAHDGKALPAR1
SCHEMBL17451093 0.95 EPHX2 (0.65) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL18177537 0.95 FFAR1 (0.60) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL2066896 0.95 EPHX2 (0.65) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL9305476 0.95 FFAR1 (0.63) FFAR1FFAR4FAAHEPHX2DGKA
SCHEMBL16153880 0.95 FFAR1 (0.69) FFAR1FFAR4FAAHDGKALPAR1
SCHEMBL25131999 0.94 FFAR1 (0.64) FFAR1FFAR4FAAHEPHX2DGKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9896608-B2 Biobased pre-polymers and uses thereof for preparing polymers which are of use as additives in a poly(lactic acid) matrix INSTITUT DES CORPS GRAS ETUDES ET RECHERCHES TECHNIQUES—ITERG (FR) 2018-02-20 US disclosed
US-20150315433-A1 BIOBASED PRE-POLYMERS AND USES THEREOF FOR PREPARING POLYMERS WHICH ARE OF USE AS ADDITIVES IN A POLY(LACTIC ACID) MATRIX UNIVERSITÉ DE BORDEAUX (FR) 2015-11-05 US disclosed
US-20150315433-A1 BIOBASED PRE-POLYMERS AND USES THEREOF FOR PREPARING POLYMERS WHICH ARE OF USE AS ADDITIVES IN A POLY(LACTIC ACID) MATRIX UNIVERSITÉ DE BORDEAUX (FR) 2015-11-05 US disclosed