SCHEMBL14626327

SCHEMBL14626327

C[C@@]1(O)[C@H](O)[C@@H](CN=O)O[C@H]1c1coc2c(=O)[nH]c(N)nc12

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PNP P00491 2/20 0.34

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
SCHEMBL3300370 0.89 PNP (0.39) PNP
SCHEMBL264086 0.89 PNP (0.39) PNP
SCHEMBL13847074 0.85 PNP (0.34) PNP
SCHEMBL264671 0.83 HPRT1 (0.41)
SCHEMBL264919 0.74 CA12 (0.38)
SCHEMBL3365046 0.70 PNP (0.54) PNP
SCHEMBL3365040 0.70 PNP (0.54) PNP
SCHEMBL264095 0.70 PNP (0.36) PNP
SCHEMBL259613 0.70 PNP (0.36) PNP
SCHEMBL3304026 0.70 PNP (0.36) 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-2007002191-A2 METHODS FOR THE PREPARATION OF 9-DEAZAPURINE DERIVATIVES BIOCRYST PHARMACEUTICALS, INC. (US) 2007-01-04 WO disclosed