SCHEMBL109120

SCHEMBL109120

NP(=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O)Oc1ccc(Br)cc1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 9/20 0.64
P2RY2 P41231 13/20 0.63
P2RY4 P51582 5/20 0.63
P2RY14 Q15391 6/20 0.63

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
SCHEMBL7127211 0.83 P2RY6 (0.80) P2RY6P2RY2P2RY4P2RY14
SCHEMBL110387 0.81 P2RY6 (0.67) P2RY6P2RY2P2RY4P2RY14
SCHEMBL4166158 0.81 P2RY6 (0.83) P2RY6P2RY2P2RY4P2RY14
SCHEMBL2683846 0.81 P2RY6 (0.83) P2RY6P2RY2P2RY4P2RY14
SCHEMBL2056709 0.81 P2RY6 (0.83) P2RY6P2RY2P2RY4P2RY14
SCHEMBL2056916 0.81 P2RY6 (0.83) P2RY6P2RY2P2RY4P2RY14
SCHEMBL2056922 0.81 P2RY6 (0.83) P2RY6P2RY2P2RY4P2RY14
SCHEMBL157645 0.81 P2RY6 (0.83) P2RY6P2RY2P2RY4P2RY14
SCHEMBL157644 0.81 P2RY6 (0.83) P2RY6P2RY2P2RY4P2RY14
SCHEMBL4071893 0.81 P2RY6 (0.83) P2RY6P2RY2P2RY4P2RY14

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
EP-2424874-A1 NOVEL PHOSPHATE MODIFIED NUCLEOSIDES USEFUL AS SUBSTRATES FOR POLYMERASES AND AS ANTIVIRAL ANGENTS Katholieke Universiteit Leuven, K.U. Leuven R&D (BE) 2012-03-07 EP disclosed