SCHEMBL134492

SCHEMBL134492

Nc1nc(N)c2[nH][c]nc2n1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.44
▸ GDA Q9Y2T3 1/20 0.44
▸ ADORA2A P29274 1/20 0.33
▸ NUDT1 P36639 1/20 0.32

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
SCHEMBL7452620 0.79 CDK2 (0.47) NUDT1
SCHEMBL7453052 0.75 CCNA2 (0.36) NUDT1
SCHEMBL534997 0.65 PNP (0.59) —
SCHEMBL2634662 0.65 NUDT1 (0.61) PDPK1GDANUDT1
SCHEMBL140621 0.63 ALDH1A1 (0.50) —
SCHEMBL31561489 0.62 PDPK1 (0.45) PDPK1GDAADORA2A
SCHEMBL16513157 0.61 PDPK1 (0.44) PDPK1GDA
SCHEMBL1705024 0.61 PDPK1 (0.44) PDPK1GDA
2,6-Diaminopurine SCHEMBL24053 0.61 PDPK1 (1.00) PDPK1GDAADORA2A
SCHEMBL5133438 0.61 ADORA2A (0.55) PDPK1GDAADORA2ANUDT1

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 98 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9884886-B2 Disulfide masked prodrug compositions and methods MERCK SHARP & DOHME (US) 2018-02-06 — — US claimed
US-9192621-B2 Esters and malonates of SATE prodrugs IDENIX PHARMACEUTICALS LLC (US) 2015-11-24 — — US claimed
WO-2015095305-A1 PRODUCTION OF CYCLIC PHOSPHATE, PHOSPHORAMIDATE, THIOPHOSPHATE, AND PHOSPHONATE NUCLEOSIDE COMPOUNDS IDENIX PHARMACEUTICALS, INC. (US) 2015-06-25 — — WO claimed
US-8076310-B2 Phosphonate nucleosides useful as active ingredients in pharmaceutical compositions for the treatment of viral infections, and intermediates for their production K.U.LEUVEN RESEARCH & DEVELOPMENT (BE) 2011-12-13 — — US claimed
US-20110009606-A1 Synthesis of 2',3' - and 3',5' -cyclic phosphate mono-and oligonucleotides CHEMGENES CORPORATION 2011-01-13 — — US claimed
WO-2009120358-A1 OLIGOMER-NITROGENOUS BASE CONJUGATES NEKTAR THERAPEUTICS (US) 2009-10-01 — — WO claimed
US-6172209-B1 MOLECULAR HYBRIDIZATION, GENETIC ENGINEERING; NUCLEASE RESISTANCE ISIS PHARMACEUTICALS INC. 2001-01-09 — — US claimed
US-5663159-A VIRICIDES INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 1997-09-02 — — US claimed
EP-0719274-A1 METHOD FOR DOSING THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 1996-07-03 — — EP claimed
WO-1995007919-A1 METHOD FOR DOSING THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 1995-03-23 — — WO claimed
WO-2024135721-A1 METHOD FOR PRODUCING PRODUCTION INTERMEDIATE, PRODUCTION INTERMEDIATE THEREOF, AND METHOD FOR PRODUCING CROSSLINKED ARTIFICIAL NUCLEIC ACID INTERMEDIATE BY USING SAME 田辺三菱製薬株式会社 2024-06-27 — — WO disclosed
EP-1301519-B2 PRODRUGS OF PHOSPHONATE NUCLEOTIDE ANALOGUES AND METHODS FOR SELECTING AND MAKING SAME GILEAD SCIENCES INC (US) 2021-11-10 — — EP disclosed
US-10961269-B2 Bridged nucleic acid GuNA, method for producing same, and intermediate compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2021-03-30 — — US disclosed
US-20190315785-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2019-10-17 — — US disclosed
EP-3539546-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS Gilead Sciences, Inc. (US) 2019-09-18 — — EP disclosed
EP-0719274-A1 METHOD FOR DOSING THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 1996-07-03 — — EP disclosed
EP-0719273-A1 NUCLEOTIDE ANALOGS GILEAD SCIENCES, INC. (US) 1996-07-03 — — EP disclosed
WO-1995007920-A1 NUCLEOTIDE ANALOGS GILEAD SCIENCES, INC. (US) 1995-03-23 — — WO disclosed
WO-1995007919-A1 METHOD FOR DOSING THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 1995-03-23 — — WO disclosed
EP-0502447-A1 Tetrahydrofuran intermediates Bristol-Myers Squibb Company (US) 1992-09-09 — — EP 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 (3 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-20110009606-A1 Synthesis of 2',3' - and 3',5' -cyclic phosphate mono-and oligonucleotides ITPA, NT5C2, NT5C3B PDPK1 2794/4885GDA 621/4885ADORA2A 369/4885
US-10961269-B2 Bridged nucleic acid GuNA, method for producing same, and intermediate compound POLRMT, POLM, NSUN2 PDPK1 1900/4885GDA 5/4885ADORA2A 932/4885
US-20190315785-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS PIK3CA, TYMP, ITPA PDPK1 112/4885GDA 444/4885ADORA2A 2410/4885

“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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