SCHEMBL4732508

SCHEMBL4732508

O=[N+]([O-])c1ccc([C@]2(n3cnc4c(O)ncnc43)C[C@H](O)[C@@H](CO)O2)cc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 13/20 0.44
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
HIF1A Q16665 1/20 0.41
ABCC4 O15439 1/20 0.41
SLC28A3 Q9HAS3 1/20 0.41
BLM P54132 1/20 0.41

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
SCHEMBL7220604 0.85 SLC28A1 (0.39) SLC29A1TP53
SCHEMBL444963 0.77 SLC28A1 (0.42) HIF1A
SCHEMBL3815627 0.75 SLC29A1 (0.50) SLC29A1TP53CYP3A4HIF1AABCC4
SCHEMBL3815635 0.75 SLC29A1 (0.44) SLC29A1TP53CYP3A4HIF1AABCC4
SCHEMBL28092439 0.75 SLC28A1 (0.42) SLC29A1HIF1ASLC28A3
SCHEMBL29406372 0.75 SLC28A1 (0.42) SLC29A1HIF1ASLC28A3
SCHEMBL27220667 0.75 SLC28A1 (0.42) SLC29A1HIF1ASLC28A3
SCHEMBL8714851 0.74 ADORA2A (0.44) SLC29A1TP53CYP3A4HIF1AABCC4
Nitrobenzene SCHEMBL28322736 0.74 SLC29A1 (0.41) SLC29A1TP53CYP3A4HIF1AABCC4
SCHEMBL28042204 0.73 SLC28A1 (0.39) SLC29A1HIF1ASLC28A3

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-2008045535-A2 CONVERTIBLE NUCLEOSIDE DERIVATIVES RESEARCH FOUNDATION OF THE CITY UNIVERSITY OF NEW YORK (US) 2008-04-17 WO disclosed