SCHEMBL4783231

SCHEMBL4783231

CC(C)(C)[Si](C)(C)[C@]1(n2cnc3c(O)ncnc32)C[C@H](O)[C@@H](CO)O1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC28A1 O00337 1/20 0.39
ADORA3 P0DMS8 3/20 0.36
ADORA2A P29274 2/20 0.36
HIF1A Q16665 1/20 0.36
PI4KA P42356 1/20 0.35
PI4K2B Q8TCG2 1/20 0.35
PI4K2A Q9BTU6 1/20 0.35
PI4KB Q9UBF8 1/20 0.35
ADORA1 P30542 3/20 0.34
SLC29A1 Q99808 1/20 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
SCHEMBL4732621 0.87 SLC28A1 (0.37) SLC28A1ADORA3ADORA2AHIF1AADORA1
SCHEMBL444963 0.81 SLC28A1 (0.42) SLC28A1ADORA3ADORA2AHIF1API4KA
SCHEMBL27220667 0.79 SLC28A1 (0.42) SLC28A1ADORA3ADORA2AHIF1API4KA
SCHEMBL28092439 0.79 SLC28A1 (0.42) SLC28A1ADORA3ADORA2AHIF1API4KA
SCHEMBL29406372 0.79 SLC28A1 (0.42) SLC28A1ADORA3ADORA2AHIF1API4KA
SCHEMBL28042204 0.78 SLC28A1 (0.39) SLC28A1ADORA3ADORA2AHIF1API4KA
SCHEMBL7220604 0.76 SLC28A1 (0.39) SLC28A1ADORA3ADORA2ASLC29A1
SCHEMBL31186229 0.74 SLC28A1 (0.38) SLC28A1ADORA3ADORA2AHIF1API4KA
SCHEMBL17460353 0.73 ADORA2A (0.42) SLC28A1ADORA3ADORA2AHIF1API4KA
SCHEMBL41364 0.72 PI4KA (0.43) SLC28A1ADORA3ADORA2API4KAPI4K2B

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