SCHEMBL8923951

SCHEMBL8923951

Nc1nc(F)nc2c1ncn2[C@@H]1O[C@H](CO)C[C@@H]1F

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NT5E P21589 4/20 0.62
LMNA P02545 1/20 0.62
HIF1A Q16665 1/20 0.62
AHCY P23526 4/20 0.56
ADORA2A P29274 4/20 0.49
ADORA2B P29275 3/20 0.49
ADORA3 P0DMS8 2/20 0.49
ADORA1 P30542 2/20 0.49
CA5A P35218 1/20 0.49
PDE2A O00408 1/20 0.48
ADRA1A P35348 1/20 0.48
PDE4D Q08499 1/20 0.48
PDE3A Q14432 1/20 0.48
DNMT1 P26358 1/20 0.45
DNMT3B Q9UBC3 1/20 0.45

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
SCHEMBL8923952 1.00 NT5E (0.62) NT5ELMNAHIF1AAHCYADORA2A
SCHEMBL26291351 1.00 NT5E (0.62) NT5ELMNAHIF1AAHCYADORA2A
SCHEMBL13890093 0.90 AHCY (0.54) NT5ELMNAHIF1AAHCYADORA2A
SCHEMBL8620311 0.90 AHCY (0.54) NT5ELMNAHIF1AAHCYADORA2A
SCHEMBL13873163 0.90 AHCY (0.54) NT5ELMNAHIF1AAHCYADORA2A
SCHEMBL8620317 0.90 AHCY (0.54) NT5ELMNAHIF1AAHCYADORA2A
SCHEMBL13713932 0.90 AHCY (0.54) NT5ELMNAHIF1AAHCYADORA2A
SCHEMBL3036906 0.89 LMNA (0.65) NT5ELMNAHIF1AAHCYADORA2A
SCHEMBL3036901 0.89 LMNA (0.65) NT5ELMNAHIF1AAHCYADORA2A
SCHEMBL21132768 0.89 LMNA (0.65) NT5ELMNAHIF1AAHCYADORA2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5661136-A 2-halo-2'-fluoro ARA adenosines as antinoplastic agents SOUTHERN RESEARCH INSTITUTE (US) 1997-08-26 US disclosed
US-5384310-A Antitumor SOUTHERN RESEARCH INSTITUTE (US) 1995-01-24 US disclosed