SCHEMBL17800845

SCHEMBL17800845

CNc1ncnc2c1c(-c1ccco1)cn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 15/20 0.66
▸ TP53 P04637 2/20 0.52
▸ PAX8 Q06710 2/20 0.52
▸ DOT1L Q8TEK3 1/20 0.52
▸ ADORA3 P0DMS8 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ SLC29A1 Q99808 1/20 0.52
▸ MITF O75030 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ CYP1A2 P05177 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ STAT6 P42226 1/20 0.51
▸ HIF1A Q16665 1/20 0.51

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
SCHEMBL17800867 0.87 ADK (0.67) ADKTP53DOT1LSLC29A1CYP1A2
SCHEMBL7070318 0.87 HTR2B (0.69) ADKTP53PAX8ADORA3SMN1; SMN2
SCHEMBL17800859 0.86 ADK (0.80) ADK
SCHEMBL16968462 0.85 DOT1L (0.71) ADKTP53PAX8DOT1LCYP1A2
SCHEMBL16978208 0.85 DOT1L (0.71) ADKTP53PAX8DOT1LCYP1A2
SCHEMBL6426263 0.85 DOT1L (0.71) ADKTP53PAX8DOT1LCYP1A2
SCHEMBL13092047 0.85 DOT1L (0.71) ADKTP53PAX8DOT1LCYP1A2
SCHEMBL6838180 0.85 ADK (0.72) ADKTP53DOT1LSLC29A1CYP1A2
SCHEMBL17800872 0.85 ADK (0.66) ADKTP53DOT1LCYP1A2MAPK1
SCHEMBL17800848 0.85 ADK (0.64) ADKTP53DOT1LCYP1A2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9586986-B2 Substituted 7-deazapurine ribonucleosides for therapeutic uses INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2017-03-07 — — US claimed
US-20160159844-A1 NOVEL SUBSTITUTED 7-DEAZAPURINE RIBONUCLEOSIDES FOR THERAPEUTIC USES INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2016-06-09 — — US claimed
US-9586986-B2 Substituted 7-deazapurine ribonucleosides for therapeutic uses INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2017-03-07 — — US disclosed
US-9586986-B2 Substituted 7-deazapurine ribonucleosides for therapeutic uses INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2017-03-07 — — US disclosed
US-9586986-B2 Substituted 7-deazapurine ribonucleosides for therapeutic uses INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2017-03-07 — — US disclosed
US-20160159844-A1 NOVEL SUBSTITUTED 7-DEAZAPURINE RIBONUCLEOSIDES FOR THERAPEUTIC USES INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2016-06-09 — — US disclosed
US-20160159844-A1 NOVEL SUBSTITUTED 7-DEAZAPURINE RIBONUCLEOSIDES FOR THERAPEUTIC USES INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2016-06-09 — — US disclosed
US-20160159844-A1 NOVEL SUBSTITUTED 7-DEAZAPURINE RIBONUCLEOSIDES FOR THERAPEUTIC USES INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2016-06-09 — — US 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-20160159844-A1 NOVEL SUBSTITUTED 7-DEAZAPURINE RIBONUCLEOSIDES FOR THERAPEUTIC USES NSUN2, DUT, TYMP ADK 418/4885TP53 764/4885PAX8 950/4885

“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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