SCHEMBL9716951

SCHEMBL9716951

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CC

nearest known ligand 0.87

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.87
LMNA P02545 1/20 0.87
PRKCA P17252 4/20 0.73
PRKCE Q02156 2/20 0.73
PRKCQ Q04759 2/20 0.73
PRKCD Q05655 2/20 0.73
LPAR3 Q9UBY5 7/20 0.68
LPAR1 Q92633 4/20 0.68
ENPP2 Q13822 3/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
LPAR2 Q9HBW0 2/20 0.67
MAPT P10636 1/20 0.62

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
SCHEMBL9716938 1.00 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL386192 0.98 ALDH1A1 (0.84) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL384809 0.98 ALDH1A1 (0.84) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL385091 0.98 ALDH1A1 (0.84) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL1479459 0.98 ALDH1A1 (0.84) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL385544 0.98 ALDH1A1 (0.84) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL3212372 0.97 ALDH1A1 (0.81) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL385090 0.93 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL384808 0.93 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL385543 0.93 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ

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
EP-0445278-A4 REDUCED CALORIE TRIGLYCERIDES IN FOODS 1992-03-11 EP disclosed
EP-0445278-A1 REDUCED CALORIE TRIGLYCERIDES IN FOODS NABISCO BRANDS, INC. (US) 1991-09-11 EP disclosed
WO-1991003944-A1 REDUCED CALORIE TRIGLYCERIDES IN FOODS NABISCO BRANDS, INC. (US) 1991-04-04 WO disclosed