SCHEMBL3318875

SCHEMBL3318875

Nc1nc2c(ncn2C2OC(C=CP(=O)(O)O)C(O)C2O)c(=O)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.59
▸ TGM2 P21980 1/20 0.55
▸ HINT1 P49773 1/20 0.54
▸ STING1 Q86WV6 2/20 0.52
▸ PDE3B Q13370 1/20 0.52
▸ PDE3A Q14432 1/20 0.52
▸ KRAS P01116 8/20 0.51
▸ FUT5 Q11128 1/20 0.49
▸ GSK3A P49840 2/20 0.49
▸ RPS6KA3 P51812 2/20 0.49
▸ MAPK14 Q16539 2/20 0.49
▸ TAAR1 Q96RJ0 1/20 0.49
▸ IMPDH2 P12268 1/20 0.49
▸ PNP P00491 1/20 0.48

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
SCHEMBL3318870 1.00 NT5E (0.59) NT5ETGM2HINT1STING1PDE3B
SCHEMBL13396564 1.00 NT5E (0.59) NT5ETGM2HINT1STING1PDE3B
SCHEMBL3313815 0.91 NT5E (0.54) NT5ETGM2HINT1STING1PDE3B
SCHEMBL3313826 0.91 NT5E (0.54) NT5ETGM2HINT1STING1PDE3B
SCHEMBL3313838 0.91 NT5E (0.54) NT5ETGM2HINT1STING1PDE3B
SCHEMBL3314655 0.89 NT5E (0.52) NT5ETGM2HINT1STING1PDE3B
SCHEMBL3314652 0.89 NT5E (0.52) NT5ETGM2HINT1STING1PDE3B
SCHEMBL13396510 0.89 NT5E (0.52) NT5ETGM2HINT1STING1PDE3B
SCHEMBL26347612 0.88 P2RY2 (0.58) NT5ETGM2HINT1STING1PDE3B
SCHEMBL6900891 0.85 AHCY (0.63) NT5ETGM2HINT1STING1PDE3B

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-8324179-B2 Nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2012-12-04 — — US disclosed
US-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-04-29 — — US disclosed
WO-2008100447-A2 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2008-08-21 — — 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-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT SLC29A1, NUDT1, EIF2AK2 NT5E 226/4885TGM2 487/4885HINT1 325/4885

“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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