SCHEMBL9239203

SCHEMBL9239203

CC(C)CCCCCCCCCCCCCCCCCc1c(C(=O)O)ccc(C(=O)O)c1CCCCCCCCCCCCCCCCCC(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.42
GRIN2D O15399 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
PPARA Q07869 2/20 0.41
HIF1A Q16665 2/20 0.41
EPAS1 Q99814 2/20 0.41
ALDH1A1 P00352 3/20 0.40
PPARG P37231 1/20 0.38
KAT8 Q9H7Z6 2/20 0.37
RARA P10276 1/20 0.37
RARG P13631 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPK1 P28482 1/20 0.37
PLK1 P53350 1/20 0.36
KDM4C Q9H3R0 2/20 0.36
KDM4A O75164 1/20 0.36
PHF8 Q9UPP1 1/20 0.36

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
SCHEMBL14989260 1.00 RARB (0.42) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL10817051 1.00 RARB (0.42) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL6445849 1.00 RARB (0.42) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL6443847 1.00 RARB (0.42) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL14835993 1.00 RARB (0.42) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL1438635 1.00 RARB (0.42) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL14989139 1.00 RARB (0.42) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL12477883 0.98 RARB (0.43) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL17999118 0.97 RARB (0.40) RARBGRIN2DGRIN2AGRIN2BGRIN2C
SCHEMBL17995595 0.94 PPARA (0.50) RARBPPARAALDH1A1PPARGKAT8

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
EP-0388197-B1 Production of terephthalate esters by degradative transesterification of scrap or virgin terephthalate polyesters SYNERGISTICS IND LTD (CA) 1995-06-21 EP claimed