SCHEMBL6758644

SCHEMBL6758644

CCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 1/20 0.98
▸ ADORA1 P30542 5/20 0.74
▸ ADORA3 P0DMS8 3/20 0.73
▸ ADORA2A P29274 3/20 0.73
▸ NFKB1 P19838 1/20 0.68
▸ THPO P40225 1/20 0.68
▸ TSHR P16473 1/20 0.68

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
SCHEMBL31628603 1.00 SLC29A1 (0.98) SLC29A1ADORA1ADORA3ADORA2ANFKB1
SCHEMBL8328951 1.00 SLC29A1 (0.98) SLC29A1ADORA1ADORA3ADORA2ANFKB1
SCHEMBL7183072 0.95 SLC29A1 (0.88) SLC29A1ADORA1ADORA3ADORA2ANFKB1
SCHEMBL8180763 0.95 SLC29A1 (0.88) SLC29A1ADORA1ADORA3ADORA2ANFKB1
SCHEMBL20626332 0.92 SLC29A1 (0.86) SLC29A1ADORA1ADORA3ADORA2ANFKB1
SCHEMBL6758909 0.92 SLC29A1 (0.86) SLC29A1ADORA1ADORA3ADORA2ANFKB1
SCHEMBL14713238 0.92 SLC29A1 (0.86) SLC29A1ADORA1ADORA3ADORA2ANFKB1
SCHEMBL20579790 0.91 SLC29A1 (0.85) SLC29A1ADORA1ADORA3ADORA2ANFKB1
SCHEMBL10886676 0.90 SLC29A1 (0.80) SLC29A1ADORA1ADORA3ADORA2ANFKB1
SCHEMBL5675424 0.90 SLC29A1 (0.80) SLC29A1ADORA1ADORA3ADORA2ANFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040110718-A1 Anti-HCV nucleoside derivatives DEVOS RENE (GB) 2004-06-10 — — US claimed
CN-1466591-A Nucleoside derivatives - 2004-01-07 — — CN claimed
WO-2002018404-A9 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C HOFFMANN LA ROCHE (CH) 2003-10-02 — — WO claimed
EP-1315736-A2 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C F. HOFFMANN-LA ROCHE AG (CH) 2003-06-04 — — EP claimed
US-20030008841-A1 Anti-HCV nucleoside derivatives F. HOFFMAN-LA ROCHE, A SWISS COMPANY (CH) 2003-01-09 — — US claimed
WO-2002018404-A2 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C F. HOFFMANN-LA ROCHE AG (CH) 2002-03-07 — — WO claimed
US-20040110718-A1 Anti-HCV nucleoside derivatives DEVOS RENE (GB) 2004-06-10 — — US disclosed
CN-1466591-A Nucleoside derivatives - 2004-01-07 — — CN disclosed
WO-2002018404-A9 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C HOFFMANN LA ROCHE (CH) 2003-10-02 — — WO disclosed
EP-1315736-A2 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C F. HOFFMANN-LA ROCHE AG (CH) 2003-06-04 — — EP disclosed
US-20030008841-A1 Anti-HCV nucleoside derivatives F. HOFFMAN-LA ROCHE, A SWISS COMPANY (CH) 2003-01-09 — — US disclosed
WO-2002018404-A2 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C F. HOFFMANN-LA ROCHE AG (CH) 2002-03-07 — — WO 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 (2 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-20030008841-A1 Anti-HCV nucleoside derivatives PNP, HAVCR2, NUDT14 SLC29A1 18/4885ADORA1 197/4885ADORA3 102/4885
US-20040110718-A1 Anti-HCV nucleoside derivatives PNP, HAVCR2, NUDT14 SLC29A1 18/4885ADORA1 197/4885ADORA3 102/4885

“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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