SCHEMBL434032

SCHEMBL434032

C=Cc1ncc2nc[nH]c2n1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL10857657 0.81 KDM4E (0.36) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL7520889 0.74 CDK1 (0.31)
SCHEMBL2968460 0.74 KDM4E (0.35) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL432902 0.70 INSR (0.43) KDM4EALDH1A1GAAHPGD
SCHEMBL10910402 0.70 KDM4E (0.32) KDM4E
SCHEMBL99268 0.69 KDM4E (0.35) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL5748053 0.69 KDM4E (0.35) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL5170025 0.69 KDM4E (0.35) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL1590661 0.69 KDM4E (0.35) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL2009845 0.69 KDM4E (0.35) KDM4EALDH1A1GLAGAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3131914-B1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS LLC (US) 2023-05-10 EP claimed
US-10202411-B2 3′-substituted methyl or alkynyl nucleosides nucleotides for the treatment of HCV IDENIX PHARMACEUTICALS LLC (US) 2019-02-12 US claimed
US-20180162898-A1 4'-OR NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS LLC (US) 2018-06-14 US claimed
EP-3131914-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV Idenix Pharmaceuticals LLC (US) 2017-02-22 EP claimed
EP-1292603-B1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS IDENIX PHARMACEUTICALS LLC (US) 2017-02-22 EP claimed
US-20170044205-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES NUCLEOTIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. 2017-02-16 US claimed
EP-3083654-A1 4'-OR NUCLEOSIDES FOR THE TREATMENT OF HCV Idenix Pharmaceuticals LLC (US) 2016-10-26 EP claimed
US-20160280729-A1 CYCLOPENTANE AND CYCLOPENTENE NUCLEOSIDE ANALOGS FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS LLC (US) 2016-09-29 US claimed
WO-2015161137-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. (US) 2015-10-22 WO claimed
WO-2015095419-A1 4'-OR NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. (US) 2015-06-25 WO claimed
US-20050137161-A1 Methods and compositions for treating hepatitis C virus IDENIX PHARMACEUTICALS LLC 2005-06-23 US claimed
US-6855821-B2 Processes for preparing 1,3-dioxolane nucleosides PHARMASSET, LTD. (US) 2005-02-15 US claimed
US-20050031588-A1 With purine or pyrimidine base; for use in combination with drugs that induce mutation in Flaviviridae at location other than mutation of nucleotide that results in change from serine to a different amino acid in highly conserved consensus sequence XRXSGXXXT of domain B of the RNA polymerase region IDENIX PHARMACEUTICALS LLC 2005-02-10 US claimed
US-20040254141-A1 2'-Fluoronucleosides NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-12-16 US claimed
US-20040181051-A1 Process for the production of 3'-nucleoside prodrugs STORER RICHARD (GB) 2004-09-16 US claimed
WO-2004058792-A1 PROCESS FOR THE PRODUCTION OF 3'-NUCLEOSIDE PRODRUGS IDENIX (CAYMAN) LIMITED (KY) 2004-07-15 WO claimed
WO-2004046331-A2 2’-BRANCHED NUCLEOSIDES AND FLAVIVIRIDAE MUTATION IDENIX (CAYMAN) LIMITED (KY) 2004-06-03 WO claimed
US-20040087806-A1 Processes for preparing 1,3-dioxolane nucleosides PHARMASSET, INC. 2004-05-06 US claimed
WO-1992017485-A1 PREPARATION OF 3'-SUBSTITUTED-2',3'-DIDEOXYNUCLEOSIDES AND 2'-DEOXYNUCLEOSIDES FROM ACYCLIC, ACHIRAL PRECURSORS EMORY UNIVERSITY (US) 1992-10-15 WO claimed
WO-1992010496-A1 ENANTIOMERICALLY PURE β-L-(-)-1,3-OXATHIOLANE NUCLEOSIDES UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1992-06-25 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 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-20050031588-A1 With purine or pyrimidine base; for use in combination with drugs that induce mutation in Flaviviridae at location other than mutation of nucleotide that results in change from serine to a different amino acid in highly conserved consensus sequence XRXSGXXXT of domain B of the RNA polymerase region PNP, NSUN2, RNGTT KDM4E 2422/4885ALDH1A1 3858/4885GLA 3159/4885
US-20050137161-A1 Methods and compositions for treating hepatitis C virus HAVCR2, HCCS, PYGL KDM4E 4340/4885ALDH1A1 929/4885GLA 474/4885
US-20040254141-A1 2'-Fluoronucleosides NSUN2, PNP, FDPS KDM4E 2653/4885ALDH1A1 3361/4885GLA 3880/4885
US-20160280729-A1 CYCLOPENTANE AND CYCLOPENTENE NUCLEOSIDE ANALOGS FOR THE TREATMENT OF HCV ZC3HAV1, HAVCR2, NSUN2 KDM4E 2632/4885ALDH1A1 1679/4885GLA 3517/4885
US-20040087806-A1 Processes for preparing 1,3-dioxolane nucleosides NUDT1, PNP, DPYD KDM4E 3697/4885ALDH1A1 274/4885GLA 2216/4885
US-20170044205-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES NUCLEOTIDES FOR THE TREATMENT OF HCV RB1, NSUN2, METTL3 KDM4E 754/4885ALDH1A1 1322/4885GLA 4184/4885
US-20040181051-A1 Process for the production of 3'-nucleoside prodrugs PNP, GART, UMPS KDM4E 2464/4885ALDH1A1 854/4885GLA 1226/4885
US-10202411-B2 3′-substituted methyl or alkynyl nucleosides nucleotides for the treatment of HCV RB1, NSUN2, METTL3 KDM4E 786/4885ALDH1A1 1311/4885GLA 4185/4885
US-20180162898-A1 4'-OR NUCLEOSIDES FOR THE TREATMENT OF HCV NSUN2, NSUN3, ZC3HAV1 KDM4E 692/4885ALDH1A1 483/4885GLA 2898/4885

“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.