SCHEMBL6426263

SCHEMBL6426263

Nc1ncnc2c1c(-c1ccco1)cn2C1OC(CO)C(O)C1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DOT1L Q8TEK3 2/20 0.71
▸ ADK P55263 12/20 0.67
▸ CCNA2 P20248 1/20 0.61
▸ CDK2 P24941 1/20 0.61
▸ CCNA1 P78396 1/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ HTT P42858 2/20 0.61
▸ NPC1 O15118 1/20 0.61
▸ GALR3 O60755 1/20 0.61
▸ S1PR4 O95977 1/20 0.61
▸ MAPT P10636 1/20 0.61
▸ S1PR1 P21453 1/20 0.61
▸ RAB9A P51151 1/20 0.61
▸ PAX8 Q06710 1/20 0.61
▸ MAPK1 P28482 2/20 0.56
▸ TDP1 Q9NUW8 2/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ STAT6 P42226 1/20 0.56
▸ HIF1A Q16665 1/20 0.56
▸ KDM4E B2RXH2 1/20 0.56

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
SCHEMBL13092047 1.00 DOT1L (0.71) DOT1LADKCCNA2CDK2CCNA1
SCHEMBL16978208 1.00 DOT1L (0.71) DOT1LADKCCNA2CDK2CCNA1
SCHEMBL16968462 1.00 DOT1L (0.71) DOT1LADKCCNA2CDK2CCNA1
SCHEMBL17800867 0.88 ADK (0.67) DOT1LADKALDH1A1HTTMAPK1
SCHEMBL6838180 0.88 ADK (0.72) DOT1LADKALDH1A1HTTMAPK1
SCHEMBL13092019 0.85 ADK (0.76) DOT1LADKALDH1A1HTTNPC1
SCHEMBL8326432 0.85 ADK (0.76) DOT1LADKALDH1A1HTTNPC1
SCHEMBL15241401 0.85 ADK (0.76) DOT1LADKALDH1A1HTTNPC1
SCHEMBL18744597 0.85 ADK (0.76) DOT1LADKALDH1A1HTTNPC1
SCHEMBL17800872 0.85 ADK (0.66) DOT1LADKALDH1A1HTTMAPK1

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
US-10294262-B2 7-deazapurine nucleosides for therapeutic uses INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2019-05-21 — — US disclosed
US-20170240584-A1 NOVEL 7-DEAZAPURINE NUCLEOSIDES FOR THERAPEUTIC USES INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR,V.V.I. (CZ) 2017-08-24 — — US disclosed
US-9624257-B2 7-deazapurine nucleosides for therapeutic uses INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ASCR, V.V.I. (CZ) 2017-04-18 — — US disclosed
EP-1501850-A2 NUCLEOSIDE DERIVATIVES FOR TREATING HEPATITIS C VIRUS INFECTION GENELABS TECHNOLOGIES, INC. (US) 2005-02-02 — — EP disclosed
US-20040063658-A1 Nucleoside derivatives for treating hepatitis C virus infection GENELABS TECHNOLOGIES, INC. 2004-04-01 — — US disclosed
WO-2003093290-A2 NUCLEOSIDE DERIVATIVES FOR TREATING HEPATITIS C VIRUS INFECTION GENELABS TECHNOLOGIES, INC. (US) 2003-11-13 — — 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 (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-20040063658-A1 Nucleoside derivatives for treating hepatitis C virus infection HAVCR2, PNP, NTPCR DOT1L 3315/4885ADK 222/4885CCNA2 1612/4885
US-10294262-B2 7-deazapurine nucleosides for therapeutic uses TPMT, TYMP, ENTPD5 DOT1L 689/4885ADK 221/4885CCNA2 814/4885
US-20170240584-A1 NOVEL 7-DEAZAPURINE NUCLEOSIDES FOR THERAPEUTIC USES TPMT, TYMP, ENTPD5 DOT1L 624/4885ADK 272/4885CCNA2 651/4885

“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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