Tricaprilin

Tricaprilin

SCHEMBL7061899

CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCC.CCCCCCCCCC(=O)O

nearest known ligand 0.87

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.87
LMNA P02545 1/20 0.87
PRKCA P17252 4/20 0.74
PRKCE Q02156 2/20 0.74
PRKCQ Q04759 2/20 0.74
PRKCD Q05655 2/20 0.74
LPAR3 Q9UBY5 7/20 0.69
LPAR1 Q92633 4/20 0.69
ENPP2 Q13822 3/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
LPAR2 Q9HBW0 2/20 0.68
TLR2 O60603 1/20 0.61

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
Dodecanoate SCHEMBL28600376 1.00 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
Dodecanoate SCHEMBL30736803 1.00 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
Stearic Acid SCHEMBL17144666 1.00 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL29626993 1.00 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
Tricaprilin SCHEMBL25199023 1.00 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
Nonanoate SCHEMBL25181546 1.00 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
Palmitic Acid SCHEMBL2788109 1.00 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
Tripalmitin SCHEMBL30991684 1.00 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL31112712 1.00 ALDH1A1 (0.87) ALDH1A1LMNAPRKCAPRKCEPRKCQ
Tripalmitin SCHEMBL29220029 1.00 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1309640-A1 POLYURETHANE FILM-FORMING DISPERSIONS IN ALCOHOL-WATER SYSTEM 3M Innovative Properties Company (US) 2003-05-14 EP disclosed
WO-2002010242-A1 POLYURETHANE FILM-FORMING DISPERSIONS IN ALCOHOL-WATER SYSTEM 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-02-07 WO disclosed