SCHEMBL16647455

SCHEMBL16647455

C[C@@]1(O)C(O)[C@@](CF)(CO[P@](O)(=S)OP(=O)(O)OP(=O)(O)O)O[C@H]1n1ccc(=O)[nH]c1=O

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 15/20 0.56
▸ P2RY4 P51582 9/20 0.56
▸ POLA1 P09884 1/20 0.49
▸ P2RY6 Q15077 6/20 0.46
▸ ENPP1 P22413 2/20 0.42

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
SCHEMBL16377324 1.00 P2RY2 (0.56) P2RY2P2RY4POLA1P2RY6ENPP1
SCHEMBL16374073 1.00 P2RY2 (0.56) P2RY2P2RY4POLA1P2RY6ENPP1
SCHEMBL16368212 1.00 P2RY2 (0.56) P2RY2P2RY4POLA1P2RY6ENPP1
SCHEMBL16647638 1.00 P2RY2 (0.56) P2RY2P2RY4POLA1P2RY6ENPP1
SCHEMBL16368213 1.00 P2RY2 (0.56) P2RY2P2RY4POLA1P2RY6ENPP1
SCHEMBL23171703 0.92 P2RY2 (0.64) P2RY2P2RY4POLA1P2RY6
SCHEMBL16376889 0.92 P2RY2 (0.64) P2RY2P2RY4POLA1P2RY6
SCHEMBL17359554 0.92 P2RY2 (0.64) P2RY2P2RY4POLA1P2RY6
SCHEMBL16374206 0.92 P2RY2 (0.64) P2RY2P2RY4POLA1P2RY6
SCHEMBL17359552 0.92 P2RY2 (0.64) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015054465-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2015-04-16 — — WO disclosed
Send feedback