SCHEMBL13057673

SCHEMBL13057673

Nc1nc2c(nnn2[C@@H]2O[C@H](OCP(=O)(O)O)C[C@H]2O)c(=O)[nH]1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 11/20 0.45
▸ HPRT1 P00492 5/20 0.44
▸ NT5E P21589 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ TLR7 Q9NYK1 1/20 0.36
▸ FUT5 Q11128 1/20 0.36

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
SCHEMBL13082345 0.86 PNP (0.51) PNPHPRT1POLB
SCHEMBL12151598 0.82 HPRT1 (0.61) PNPHPRT1NT5EPOLBFUT5
SCHEMBL3759846 0.82 HPRT1 (0.61) PNPHPRT1NT5EPOLBFUT5
SCHEMBL12154664 0.82 HPRT1 (0.61) PNPHPRT1NT5EPOLBFUT5
SCHEMBL13057657 0.80 TLR7 (0.36) PNPTLR7FUT5
SCHEMBL13057646 0.78 AHCY (0.45) NT5EPOLB
SCHEMBL3761353 0.78 AHCY (0.45) NT5EPOLB
SCHEMBL12300446 0.78 HPRT1 (0.43) PNPHPRT1NT5EPOLBTLR7
SCHEMBL3313805 0.78 PNP (0.40) PNPHPRT1NT5EPOLBTLR7
SCHEMBL13396453 0.78 PNP (0.40) PNPHPRT1NT5EPOLBTLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842672-B2 Phosphonate inhibitors of HCV GILEAD SCIENCES, INC. (US) 2010-11-30 — — US disclosed
US-20080107628-A1 Polymerase inhibitors GILEAD SCIENCES, INC. 2008-05-08 — — US disclosed
WO-2008005542-A2 ANTIVIRAL PHOSPHINATE COMPOUNDS GILEAD SCIENCES, INC., (US) 2008-01-10 — — 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 (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-20080107628-A1 Polymerase inhibitors POLR2H, POLR2E, POLR1E PNP 80/4885HPRT1 529/4885NT5E 3704/4885

“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.

Send feedback