SCHEMBL31228228

SCHEMBL31228228

[N-]=[N+]=N[C@]1(CI)O[C@@H](n2ccc3c(NC(=O)c4ccccc4)ncnc32)[C@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 2/20 0.35
▸ POLB P06746 1/20 0.34
▸ PRMT5 O14744 5/20 0.33
▸ WDR77 Q9BQA1 5/20 0.33
▸ P2RX3 P56373 1/20 0.32
▸ P2RX4 Q99571 1/20 0.32
▸ P2RX2 Q9UBL9 1/20 0.32
▸ PRMT6 Q96LA8 1/20 0.32
▸ METTL3 Q86U44 1/20 0.31
▸ METTL14 Q9HCE5 1/20 0.31
▸ NT5E P21589 1/20 0.30
▸ P2RY6 Q15077 1/20 0.30
▸ P2RY14 Q15391 1/20 0.30
▸ ENPP1 P22413 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
SCHEMBL31228507 0.93 ADK (0.36) ADKPOLBPRMT5WDR77P2RX3
SCHEMBL31228638 0.85 ADK (0.38) ADKPOLBPRMT5WDR77P2RX3
SCHEMBL31228231 0.80 ADK (0.36) ADKPOLBPRMT5WDR77P2RX3
SCHEMBL13524029 0.76 POLB (0.39) POLBNT5EP2RY6P2RY14
SCHEMBL13523538 0.76 POLB (0.39) POLBNT5EP2RY6P2RY14
SCHEMBL16373883 0.76 POLB (0.49) POLBNT5EP2RY6P2RY14
SCHEMBL16214939 0.76 POLB (0.47) POLBNT5EP2RY6P2RY14
SCHEMBL15281797 0.76 POLB (0.47) POLBNT5EP2RY6P2RY14
SCHEMBL16870505 0.75 PRMT6 (0.40) P2RX3P2RX4P2RX2PRMT6P2RY6
SCHEMBL16214970 0.72 LMNA (0.37) —

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
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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