SCHEMBL4619792

SCHEMBL4619792

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

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DUT P33316 2/20 0.50
P2RY2 P41231 14/20 0.49
P2RY4 P51582 8/20 0.49
POLA1 P09884 1/20 0.47
P2RY6 Q15077 6/20 0.46
P2RY14 Q15391 1/20 0.44

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
SCHEMBL27341456 0.86 P2RY2 (0.58) DUTP2RY2P2RY4POLA1P2RY6
SCHEMBL4348233 0.85 P2RY2 (0.51) DUTP2RY2P2RY4POLA1P2RY6
SCHEMBL2811543 0.85 DUT (0.61) DUTP2RY2P2RY4POLA1P2RY6
SCHEMBL3487624 0.84 POLB (0.45) POLA1
SCHEMBL5285299 0.84 POLB (0.57) POLA1
SCHEMBL14913972 0.84 DUT (0.51) DUTP2RY2P2RY4POLA1P2RY6
SCHEMBL8600344 0.83 DUT (0.47) DUTP2RY2P2RY4POLA1P2RY6
SCHEMBL29431049 0.83 DUT (0.56) DUTP2RY2P2RY4POLA1P2RY6
SCHEMBL95679 0.82 P2RY2 (0.44) DUTP2RY2P2RY4POLA1P2RY6
SCHEMBL8099833 0.80 DUT (0.59) DUTP2RY2P2RY4P2RY6

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-1885876-A2 MACROMOLECULAR NUCLEOTIDE LINKS AND METHODS FOR THEIR USE Genovoxx GmbH (DE) 2008-02-13 EP disclosed
WO-2006097320-A2 MACROMOLECULAR NUCLEOTIDE LINKS AND METHODS FOR THEIR USE GENOVOXX GMBH (DE) 2006-09-21 WO disclosed