SCHEMBL1830731

SCHEMBL1830731

COCC1COC2(CC(C)(C)N([O])C(C)(C)C2)O1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.36
GAA P10253 1/20 0.31
HTR1A P08908 3/20 0.31
ADRA1B P35368 3/20 0.31
ADRA1D P25100 2/20 0.31
ADRA1A P35348 2/20 0.31
MAOA P21397 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
SCHEMBL3930163 0.89 CA2 (0.31) CA2
SCHEMBL10164190 0.84 CA2 (0.33) CA2
SCHEMBL1830733 0.84 CA2 (0.33) CA2
SCHEMBL8703788 0.83 GAA (0.34) GAA
SCHEMBL1830092 0.81 GAA (0.33) GAA
SCHEMBL11449758 0.78 CA2 (0.34) CA2
SCHEMBL3930168 0.77
SCHEMBL3927061 0.74 GAA (0.31) GAA
SCHEMBL3918565 0.72 CA2 (0.30) CA2
SCHEMBL10994708 0.72 CA2 (0.33) CA2

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-1540038-B1 METHOD FOR PREPARING A POLYCARBOXYLIC COMPOSITION COMPRISING AN ELECTROCHEMICAL OXIDATION STAGE OF A MONOSACCHARIDE COMPOSITION ROQUETTE FRERES (FR) 2011-05-11 EP disclosed
US-7728170-B2 Method for preparing a polycarboxylic composition comprising an electrochemical oxidation stage of a monosaccharide composition ROQUETTE FRERES (FR) 2010-06-01 US disclosed
US-20050252785-A1 Method for preparing a polycarboxylic composition comprising an electrochemical oxidation stage of a monosaccharide composition ROQUETTE FRERES (FR) 2005-11-17 US disclosed