SCHEMBL31228217

SCHEMBL31228217

Cc1nc(N)c2c(C(N)=O)cn([C@@H]3O[C@@](CO)(N=[N+]=[N-])[C@@H](O)[C@H]3O)c2n1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 4/20 0.39
▸ NPC1 O15118 1/20 0.32
▸ GALR3 O60755 1/20 0.32
▸ S1PR4 O95977 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ S1PR1 P21453 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ POLRMT O00411 1/20 0.30

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
SCHEMBL18503333 1.00 ADK (0.39) ADKNPC1GALR3S1PR4ALDH1A1
SCHEMBL18484786 0.88 POLRMT (0.32) ADKPOLRMT
SCHEMBL18484798 0.88 POLRMT (0.32) ADKPOLRMT
SCHEMBL18483545 0.85 ADK (0.40) ADKPAX8
SCHEMBL19101855 0.82 ADK (0.43) ADKNPC1GALR3S1PR4ALDH1A1
SCHEMBL18483552 0.81 ADK (0.42) ADKNPC1GALR3S1PR4ALDH1A1
SCHEMBL31228221 0.81 ADK (0.42) ADKNPC1GALR3S1PR4ALDH1A1
SCHEMBL18483544 0.78 ADK (0.55) ADKNPC1GALR3S1PR4ALDH1A1
SCHEMBL18486862 0.77 ALDH1A1 (0.44) ADKNPC1GALR3S1PR4ALDH1A1
SCHEMBL18503329 0.76 ALDH1A1 (0.52) ADKNPC1GALR3S1PR4ALDH1A1

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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