SCHEMBL599196

SCHEMBL599196

Nc1nc2c(ncn2[C@@H]2O[C@H](COC3CC3)[C@@H](O)[C@H]2O)c(=O)[nH]1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HINT1 P49773 6/20 0.68
NT5E P21589 1/20 0.68
ADORA3 P0DMS8 1/20 0.67
GSK3A P49840 2/20 0.64
RPS6KA3 P51812 2/20 0.64
MAPK14 Q16539 2/20 0.64
PNP P00491 1/20 0.64
TGM2 P21980 1/20 0.63
KRAS P01116 7/20 0.59
FUT5 Q11128 1/20 0.59

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
SCHEMBL2275000 0.96 HINT1 (0.66) HINT1NT5EADORA3GSK3ARPS6KA3
SCHEMBL18520136 0.89 HINT1 (0.69) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL3514472 0.88 HINT1 (0.73) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL3970953 0.88 HINT1 (0.73) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL17355882 0.88 HINT1 (0.73) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL1138984 0.87 HINT1 (0.75) HINT1NT5EADORA3GSK3ARPS6KA3
SCHEMBL2014087 0.87 HINT1 (0.72) HINT1NT5EGSK3ARPS6KA3MAPK14
SCHEMBL7111080 0.87 HINT1 (0.72) HINT1NT5EGSK3ARPS6KA3MAPK14
2'-Beta-Methyl-Guanosine SCHEMBL14178410 0.87 HINT1 (0.75) HINT1NT5EADORA3GSK3ARPS6KA3
2'-Beta-Methyl-Guanosine SCHEMBL11965261 0.87 HINT1 (0.75) HINT1NT5EADORA3GSK3ARPS6KA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210024565-A1 MODIFIED 2' AND 3'-NUCLEOSIDE PRODRUGS FOR TREATING FLAVIVIRIDAE INFECTIONS IDENIX PHARMACEUTICALS LLC (US) 2021-01-28 US disclosed
US-10758557-B2 Methods and compositions for treating hepatitis C virus IDENIX PHARMACEUTICALS LLC (US) 2020-09-01 US disclosed
US-20190290670-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS IDENIX PHARMACEUTICALS LLC (US) 2019-09-26 US disclosed
US-10363265-B2 Methods and compositions for treating hepatitis C virus IDENIX PHARMACEUTICALS LLC (US) 2019-07-30 US disclosed
US-20180235993-A1 METHODS AND COMPOSITIONS FOR TREATING FLAVIVIRUSES AND PESTIVIRUSES IDENIX PHARMACEUTICALS LLC (US) 2018-08-23 US disclosed
US-20180237467-A1 MODIFIED 2' AND 3'-NUCLEOSIDE PRODRUGS FOR TREATING FLAVIVIRIDAE INFECTIONS IDENIX PHARMACEUTICALS LLC (US) 2018-08-23 US disclosed
US-9968628-B2 Methods and compositions for treating flaviviruses and pestiviruses IDENIX PHARMACEUTICALS LLC (US) 2018-05-15 US disclosed
US-20170088577-A1 MODIFIED 2' AND 3'-NUCLEOSIDE PRODRUGS FOR TREATING FLAVIVIRIDAE INFECTIONS IDENIX PHARMACEUTICALS LLC (US) 2017-03-30 US disclosed
CN-104163841-B For treating 2 ' and 3 '-nucleoside prodrugs of the modification of flaviviridae infections 埃迪尼克斯医药公司 2016-08-24 CN disclosed
US-9216960-B2 Spiro[2.4]heptanes for treatment of Flaviviridae infections UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2015-12-22 US disclosed
WO-2004003000-A2 1’-, 2'- AND 3'- MODIFIED NUCLEOSIDE DERIVATIVES FOR TREATING FLAVIVIRIDAE INFECTIONS IDENIX (CAYMAN) LIMITED (KY) 2004-01-08 WO disclosed
CN-1443191-A Methods and compositions for treating hepatitis c virus IDENNIKOS KY CO LTD (KY) 2003-09-17 CN disclosed
WO-2003026675-A1 METHODS AND COMPOSITIONS FOR TREATING FLAVIVIRUSES AND PESTIVIRUSES USING 4'-MODIFIED NUCLEOSIDE IDENIX (CAYMAN) LIMITED (KY) 2003-04-03 WO disclosed
WO-2003026589-A2 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS USING 4'-MODIFIED NUCLEOSIDES IDENIX (CAYMAN) LIMITED (KY) 2003-04-03 WO disclosed
US-20030060400-A1 Methods and compositions for treating flaviviruses and pestiviruses IDENIX PHARMACEUTICALS LLC 2003-03-27 US disclosed
EP-1294735-A2 METHODS AND COMPOSITIONS FOR TREATING FLAVIVIRUSES AND PESTIVIRUSES Novirio Pharmaceuticals Limited (KY) 2003-03-26 EP disclosed
EP-1292603-A2 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS Novirio Pharmaceuticals Limited (KY) 2003-03-19 EP disclosed
US-20030050229-A1 Methods and compositions for treating hepatitis C virus IDENIX PHARMACEUTICALS LLC 2003-03-13 US disclosed
WO-2001092282-A2 METHODS AND COMPOSITIONS FOR TREATING FLAVIVIRUSES AND PESTIVIRUSES IDENIX (CAYMAN) LIMITED (KY) 2001-12-06 WO disclosed
WO-2001090121-A2 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS IDENIX (CAYMAN) LIMITED (KY) 2001-11-29 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 (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-20180235993-A1 METHODS AND COMPOSITIONS FOR TREATING FLAVIVIRUSES AND PESTIVIRUSES MTAP, PHOSPHO1, PNP HINT1 421/4885NT5E 324/4885ADORA3 1821/4885
US-10758557-B2 Methods and compositions for treating hepatitis C virus HAVCR2, HCCS, PYGL HINT1 587/4885NT5E 407/4885ADORA3 482/4885
US-20030060400-A1 Methods and compositions for treating flaviviruses and pestiviruses PHOSPHO1, MTAP, PNP HINT1 528/4885NT5E 577/4885ADORA3 1595/4885
US-20190290670-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS HAVCR2, HCCS, PYGL HINT1 587/4885NT5E 407/4885ADORA3 482/4885
US-10363265-B2 Methods and compositions for treating hepatitis C virus HAVCR2, HCCS, PYGL HINT1 587/4885NT5E 407/4885ADORA3 482/4885
US-20180237467-A1 MODIFIED 2' AND 3'-NUCLEOSIDE PRODRUGS FOR TREATING FLAVIVIRIDAE INFECTIONS PNP, UGT1A3, UGT2B7 HINT1 315/4885NT5E 50/4885ADORA3 178/4885
US-20030050229-A1 Methods and compositions for treating hepatitis C virus HAVCR2, HCCS, SLC10A1 HINT1 417/4885NT5E 392/4885ADORA3 330/4885
US-20170088577-A1 MODIFIED 2' AND 3'-NUCLEOSIDE PRODRUGS FOR TREATING FLAVIVIRIDAE INFECTIONS PNP, UGT1A3, UGT2B7 HINT1 315/4885NT5E 50/4885ADORA3 178/4885
US-20210024565-A1 MODIFIED 2' AND 3'-NUCLEOSIDE PRODRUGS FOR TREATING FLAVIVIRIDAE INFECTIONS PNP, UGT1A3, SLC29A2 HINT1 363/4885NT5E 65/4885ADORA3 132/4885

“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.