SCHEMBL4337034

SCHEMBL4337034

O=C(OC(=O)OC(=O)C(O)CO)OC(=O)C(O)CO

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.43
SOAT1 P35610 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
SCHEMBL265908 0.97 OR51E2 (0.46) OR51E2SOAT1
SCHEMBL3701302 0.86 ALDH1A1 (0.38) OR51E2SOAT1
SCHEMBL93977 0.86 OR51E2 (0.50) OR51E2
SCHEMBL6249794 0.83 OR51E2 (0.48) OR51E2
Water SCHEMBL22418485 0.83 OR51E2 (0.55) OR51E2
SCHEMBL4985589 0.83 OR51E2 (0.48) OR51E2
Ethylene Glycol SCHEMBL3837465 0.81 OR51E2 (0.46) OR51E2
Ethylene SCHEMBL15065634 0.81 OR51E2 (0.46) OR51E2
Propane SCHEMBL21814344 0.79 OR51E2 (0.43) OR51E2SOAT1
Alcohol SCHEMBL6238241 0.79 OR51E2 (0.43) OR51E2SOAT1

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-2009145624-A1 USE OF ACTIVATED CARBON DIOXIDE IN THE OXIDATION OF COMPOUNDS HAVING A HYDROXY GROUP INOVIAKEM B.V. (NL) 2009-12-03 WO disclosed