SCHEMBL9355751

SCHEMBL9355751

CC(C)(CCO)OC(=O)C(C)(C)CO

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
GAA P10253 1/20 0.31

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
SCHEMBL17365963 0.85 CYP4F2 (0.39) CYP4F2CYP4A11GAA
SCHEMBL27968459 0.82 PRKCA (0.35) CYP4F2CYP4A11GAA
SCHEMBL9115447 0.80 TSHR (0.35) CYP4F2CYP4A11
SCHEMBL24349883 0.79 CYP4F2 (0.32) CYP4F2CYP4A11
SCHEMBL16342188 0.79 CYP4F2 (0.35) CYP4F2CYP4A11GAA
SCHEMBL23662367 0.78 CYP4F2 (0.32) CYP4F2CYP4A11GAA
SCHEMBL1735484 0.77 DGAT1 (0.46) CYP4F2CYP4A11GAA
SCHEMBL1930634 0.77 GAA (0.36) CYP4F2CYP4A11GAA
SCHEMBL5691079 0.75 GAA (0.50) CYP4F2CYP4A11GAA
SCHEMBL28375445 0.75 GAA (0.34) CYP4F2CYP4A11GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623154-A1 TERNARY MIXTURES OF GLYCOLS AND WATER THAT RETAIN FLUIDITY AT AMBIENT TEMPERATURES EASTMAN CHEMICAL COMPANY (US) 1994-11-09 EP claimed
WO-1993015128-A1 TERNARY MIXTURES OF GLYCOLS AND WATER THAT RETAIN FLUIDITY AT AMBIENT TEMPERATURES EASTMAN CHEMICAL COMPANY (US) 1993-08-05 WO claimed
EP-0623154-A1 TERNARY MIXTURES OF GLYCOLS AND WATER THAT RETAIN FLUIDITY AT AMBIENT TEMPERATURES EASTMAN CHEMICAL COMPANY (US) 1994-11-09 EP disclosed
WO-1993015128-A1 TERNARY MIXTURES OF GLYCOLS AND WATER THAT RETAIN FLUIDITY AT AMBIENT TEMPERATURES EASTMAN CHEMICAL COMPANY (US) 1993-08-05 WO disclosed
EP-0025527-A1 A composition containing a half ester of an organic polyol, an unsaturated monomer, an epoxide and a basic compound UNION CARBIDE CORPORATION (US) 1981-03-25 EP disclosed
EP-0025178-A1 A composition containing a half ester of an organic polyol, an unsaturated monomer, an epoxide, and reinforcing fiber UNION CARBIDE CORPORATION (US) 1981-03-18 EP disclosed