SCHEMBL13178208

SCHEMBL13178208

O=NC[C@H]1CN(Cc2c[nH]c3c(=O)[nH]cnc23)C[C@@H]1O

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PNP P00491 17/20 0.78

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
Ulodesine SCHEMBL4736609 0.88 PNP (1.00) PNP
Ulodesine SCHEMBL12715509 0.88 PNP (1.00) PNP
Ulodesine SCHEMBL13606448 0.88 PNP (1.00) PNP
Ulodesine SCHEMBL474735 0.88 PNP (1.00) PNP
SCHEMBL15315689 0.87 PNP (0.81) PNP
SCHEMBL9888172 0.87 PNP (0.81) PNP
SCHEMBL9888126 0.85 PNP (0.78) PNP
SCHEMBL15315687 0.85 PNP (0.78) PNP
SCHEMBL9888032 0.85 PNP (0.82) PNP
SCHEMBL15318135 0.85 PNP (0.78) PNP

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-2010111381-A2 USEFUL PHARMACEUTICAL SALTS OF 7-[(3R, 4R)-3-HYDROXY-4-HYDROXYMETHYL-PYRROLIDIN-1-YLMETHYL]-3,5-DIHYDRO-PYRROLO[3,2-D]PYRIMIDIN-4-ONE BIOCRYST PHARMACEUTICALS, INC. (US) 2010-09-30 WO disclosed