SCHEMBL13847202

SCHEMBL13847202

C[C@@]1(O)[C@H](O)C(O)O[C@H]1c1n[nH]c2c(N)ncnc12

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 2/20 0.34
▸ MTAP Q13126 7/20 0.33
▸ PRMT5 O14744 5/20 0.32
▸ WDR77 Q9BQA1 5/20 0.32
▸ ADORA3 P0DMS8 1/20 0.31
▸ PNP P00491 1/20 0.30
▸ DGAT1 O75907 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
SCHEMBL13847060 0.85 ADORA2A (0.48) ADORA2AADORA3PNP
SCHEMBL3986874 0.85 ADORA2A (0.48) ADORA2AADORA3PNP
SCHEMBL13843297 0.85 ADORA2A (0.48) ADORA2AADORA3PNP
SCHEMBL13847233 0.79 MTAP (0.50) MTAPPNP
SCHEMBL13847197 0.78 ADORA2A (0.35) ADORA2APRMT5WDR77ADORA3
SCHEMBL13846986 0.74 PNP (0.34) PNP
SCHEMBL13847172 0.73 ADORA2A (0.35) ADORA2APRMT5WDR77ADORA3
SCHEMBL13847181 0.68 ADORA2A (0.34) ADORA2AADORA3
SCHEMBL13847179 0.68 MTAP (0.52) MTAPPNP
SCHEMBL866604 0.67 PI4KA (0.50) ADORA2AADORA3PNP

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-7534767-B2 C-purine nucleoside analogs as inhibitors of RNA-dependent RNA viral polymerase MERCK & CO., INC. (US) 2009-05-19 — — US disclosed
US-20080021047-A1 C-Purine Nucleoside Analogs As Inhibitors Of Rna-Dependent Rna Viral Polymerase MERCK SHARP & DOHME LLC 2008-01-24 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080021047-A1 C-Purine Nucleoside Analogs As Inhibitors Of Rna-Dependent Rna Viral Polymerase NSUN2, PNP, RNGTT ADORA2A 106/4885MTAP 9/4885PRMT5 549/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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