SCHEMBL4779843

SCHEMBL4779843

O=c1ccn([C@@H]2O[C@H](C(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2F)c(=O)[nH]1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 16/20 0.55
P2RY4 P51582 8/20 0.54
P2RY6 Q15077 8/20 0.52
POLA1 P09884 1/20 0.48

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
SCHEMBL5068300 0.91 P2RY2 (0.63) P2RY2P2RY4P2RY6
SCHEMBL622268 0.89 P2RY2 (0.62) P2RY2P2RY4P2RY6
SCHEMBL622267 0.89 P2RY2 (0.62) P2RY2P2RY4P2RY6
Uridine SCHEMBL5875823 0.84 P2RY2 (0.65) P2RY2P2RY4P2RY6
Uridine SCHEMBL5875869 0.84 P2RY2 (0.65) P2RY2P2RY4P2RY6
Uridine SCHEMBL338288 0.84 P2RY2 (0.65) P2RY2P2RY4P2RY6
SCHEMBL18770063 0.82 P2RY2 (0.62) P2RY2P2RY4P2RY6
SCHEMBL607048 0.82 P2RY2 (0.62) P2RY2P2RY4P2RY6
SCHEMBL4376269 0.81 POLG (0.56) P2RY2P2RY4P2RY6
SCHEMBL2167291 0.80 P2RY2 (0.62) P2RY2P2RY4P2RY6

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-2008022469-A1 2'-DEOXY-2'-FLUORO-β-D-ARABINONUCLEOSIDE 5'-TRIPHOSPHATES AND THEIR USE IN ENZYMATIC NUCLEIC ACID SYNTHESIS MCGILL UNIVERSITY (CA) 2008-02-28 WO disclosed