SCHEMBL913469

SCHEMBL913469

C#C[C@]1(COC(c2ccccc2)(c2ccc(OC)cc2)c2ccc(OC)cc2)O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@@H]1F

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TK1 P04183 6/20 0.40
TK2 O00142 10/20 0.39
NT5M Q9NPB1 1/20 0.37

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
SCHEMBL18315872 0.91 TK1 (0.41) TK1TK2NT5M
SCHEMBL913471 0.88 TK1 (0.36) TK1TK2NT5M
SCHEMBL6830445 0.83 TK1 (0.42) TK1TK2NT5M
SCHEMBL6830442 0.83 TK1 (0.42) TK1TK2NT5M
SCHEMBL18315873 0.79 TK1 (0.39) TK1TK2NT5M
SCHEMBL6873193 0.78 TK1 (0.42) TK1TK2NT5M
SCHEMBL25765053 0.77 TK1 (0.42) TK1TK2
SCHEMBL6830069 0.77 TK1 (0.38) TK1TK2
SCHEMBL6827522 0.77 TK1 (0.38) TK1TK2
SCHEMBL23069380 0.76 TK2 (0.40) TK1TK2NT5M

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3159351-A2 MODIFIED 3'-AZIDO-4'-ETHYNYL-NUCLEOSIDES AS ANTIVIRAL AGENTS Gilead Pharmasset LLC (US) 2017-04-26 EP disclosed
EP-1937825-B1 MODIFIED 4'-NUCLEOSIDES AS ANTIVIRAL AGENTS GILEAD PHARMASSET LLC (US) 2016-12-21 EP disclosed
US-8569478-B2 Modified 4′-nucleosides as antiviral agents GILEAD PHARMASSET LLC (US) 2013-10-29 US disclosed
US-20110021454-A1 MODIFIED 4`-NUCLEOSIDES AS ANTIVIRAL AGENTS PHARMASSET, INC. (US) 2011-01-27 US disclosed
EP-1937825-A2 MODIFIED 4'-NUCLEOSIDES AS ANTIVIRAL AGENTS Pharmasset, Inc. (US) 2008-07-02 EP disclosed
WO-2007038507-A2 MODIFIED 4'-NUCLEOSIDES AS ANTIVIRAL AGENTS PHARMASSET, INC. (US) 2007-04-05 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-20110021454-A1 MODIFIED 4`-NUCLEOSIDES AS ANTIVIRAL AGENTS MTAP, PNP, SAMHD1 TK1 93/4885TK2 315/4885NT5M 185/4885

“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.