SCHEMBL9752745

SCHEMBL9752745

CCCCCC(=O)c1c(O)c(C)c(O)c(C(=O)CCCCC)c1O

nearest known ligand 0.96

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.96
PLA2G5 P39877 2/20 0.96
FFAR1 O14842 2/20 0.62
FASN P49327 1/20 0.58
ALDH1A1 P00352 2/20 0.53
MAPT P10636 2/20 0.53
HTT P42858 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ATM Q13315 1/20 0.53
ELANE P08246 2/20 0.47
HSD17B3 P37058 6/20 0.47
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL9752731 0.98 PLA2G2A (1.00) PLA2G2APLA2G5FFAR1FASNALDH1A1
SCHEMBL9752639 0.98 PLA2G2A (1.00) PLA2G2APLA2G5FFAR1FASNALDH1A1
SCHEMBL9752630 0.98 PLA2G2A (1.00) PLA2G2APLA2G5FFAR1FASNALDH1A1
SCHEMBL9752640 0.94 PLA2G2A (0.85) PLA2G2APLA2G5FFAR1FASNALDH1A1
SCHEMBL9752842 0.85 FASN (0.75) PLA2G2APLA2G5FFAR1FASNALDH1A1
SCHEMBL11068812 0.79 PLA2G2A (0.68) PLA2G2APLA2G5FFAR1FASNALDH1A1
SCHEMBL25916155 0.79 PLA2G2A (0.63) PLA2G2APLA2G5FFAR1FASNALDH1A1
SCHEMBL9752583 0.78 PLA2G2A (0.96) PLA2G2APLA2G5FFAR1FASNALDH1A1
SCHEMBL9752843 0.77 PLA2G2A (1.00) PLA2G2APLA2G5FFAR1ALDH1A1MAPT
SCHEMBL9752712 0.77 PLA2G2A (1.00) PLA2G2APLA2G5FFAR1ALDH1A1MAPT

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
WO-1991009595-A1 ANTI-VIRAL COMPOSITIONS SMITHKLINE BEECHAM CORPORATION (US) 1991-07-11 WO disclosed