SCHEMBL31228204

SCHEMBL31228204

C[C@]1(O)[C@H](n2cnc3c(N)nc(N)nc32)O[C@](F)(CO)[C@H]1O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 4/20 0.50
▸ AHCY P23526 1/20 0.45
▸ ADA P00813 1/20 0.44
▸ HSP90B1 P14625 2/20 0.44
▸ HINT1 P49773 2/20 0.41
▸ ADORA3 P0DMS8 3/20 0.41
▸ NT5E P21589 3/20 0.40
▸ LMNA P02545 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ CDK1 P06493 1/20 0.39
▸ CCNB1 P14635 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ CYP2C19 P33261 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.37

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
SCHEMBL19859703 0.90 ADORA2A (0.46) ADORA2AAHCYADAHSP90B1HINT1
SCHEMBL19859805 0.86 ADORA2A (0.62) ADORA2AAHCYADORA3
SCHEMBL21078466 0.85 AHCY (0.43) ADORA2AAHCYADAHSP90B1ADORA3
SCHEMBL15833022 0.82 ADORA3 (0.52) ADORA2AHINT1ADORA3NT5E
SCHEMBL15833215 0.82 ADORA3 (0.52) ADORA2AHINT1ADORA3NT5E
SCHEMBL15837259 0.79 ADORA3 (0.39) ADORA2AADAHINT1ADORA3
SCHEMBL21078497 0.79 ADORA3 (0.49) ADORA2AADORA3LMNA
SCHEMBL31228203 0.78 ADORA2A (0.39) ADORA2AAHCYADAHSP90B1HINT1
SCHEMBL19778486 0.78 HTR2C (0.41) ADORA2AAHCYADAHSP90B1ADORA3
SCHEMBL21015191 0.78 ADORA3 (0.53) ADORA2AAHCYADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4705313-A2 4'-SUBSTITUTED NUCLEOSIDES AND NUCLEOTIDES AS ANTIVIRAL AGENTS The Scripps Research Institute (US) 2026-03-11 — — EP claimed
WO-2024227159-A2 4'-SUBSTITUTED NUCLEOSIDES AND NUCLEOTIDES AS ANTIVIRAL AGENTS THE SCRIPPS RESEARCH INSTITUTE (US) 2024-10-31 — — WO claimed
EP-4705313-A2 4'-SUBSTITUTED NUCLEOSIDES AND NUCLEOTIDES AS ANTIVIRAL AGENTS The Scripps Research Institute (US) 2026-03-11 — — EP disclosed
WO-2024227159-A2 4'-SUBSTITUTED NUCLEOSIDES AND NUCLEOTIDES AS ANTIVIRAL AGENTS THE SCRIPPS RESEARCH INSTITUTE (US) 2024-10-31 — — WO disclosed
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