SCHEMBL5034568

SCHEMBL5034568

CC(=O)[C@@]1(O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(O)C(C)=O

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 16/20 0.66
P2RY4 P51582 11/20 0.66
POLA1 P09884 1/20 0.60
P2RY6 Q15077 8/20 0.52

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
SCHEMBL9465485 0.85 P2RY2 (0.70) P2RY2P2RY4POLA1P2RY6
SCHEMBL31552883 0.84 P2RY2 (0.60) P2RY2P2RY4POLA1P2RY6
SCHEMBL6220748 0.81 P2RY2 (0.43) P2RY2P2RY4POLA1P2RY6
SCHEMBL18672155 0.81 P2RY2 (0.63) P2RY2P2RY4POLA1P2RY6
SCHEMBL18672084 0.79 P2RY2 (0.60) P2RY2P2RY4POLA1P2RY6
SCHEMBL18672128 0.79 POLA1 (0.62) P2RY2P2RY4POLA1P2RY6
SCHEMBL19558286 0.79 P2RY2 (1.00) P2RY2P2RY4POLA1P2RY6
SCHEMBL17972338 0.79 P2RY2 (1.00) P2RY2P2RY4POLA1P2RY6
SCHEMBL1979436 0.79 P2RY2 (1.00) P2RY2P2RY4POLA1P2RY6
SCHEMBL4575983 0.79 P2RY2 (0.79) P2RY2P2RY4POLA1P2RY6

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-1951308-B1 COMBINATION PREPARATIONS CONTAINING PHYSIOLOGICAL CELL MEMBRANE CONSTITUENTS INCLUDING PHOSPHATIDYLSERINE, CHOLINE AND A PYRIMIDINE NUCLEOSIDE/NUCLEOTIDE SUSILO GISELA (DE) 2013-02-20 EP disclosed
EP-1951308-A1 COMBINATION PREPARATIONS CONTAINING PHYSIOLOGICAL CELL MEMBRANE CONSTITUENTS INCLUDING PHOSPHATIDYLSERINE, CHOLINE AND A PYRIMIDINE NUCLEOSIDE/NUCLEOTIDE Susilo, Gisela (DE) 2008-08-06 EP disclosed
WO-2007059762-A1 COMBINATION PREPARATIONS CONTAINING PHYSIOLOGICAL CELL MEMBRANE CONSTITUENTS INCLUDING PHOSPHATIDYLSERINE, CHOLINE AND A PYRIMIDINE NUCLEOSIDE/NUCLEOTIDE SUSILO GISELA (DE) 2007-05-31 WO disclosed