SCHEMBL532593

SCHEMBL532593

COc1ccc(C(Nc2ncnc3c2ncn3[C@H]2C[C@@H](OC(=O)c3ccccc3)[C@H](COC(c3ccccc3)(c3ccccc3)c3ccc(OC)cc3)O2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TYMP P19971 8/20 0.46
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
POLB P06746 1/20 0.39
ADORA1 P30542 1/20 0.37

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
SCHEMBL532594 0.93 POLB (0.41) TYMPADORA2AADORA2BPOLBADORA1
SCHEMBL21577261 0.92 TYMP (0.46) TYMPADORA2AADORA2BPOLB
SCHEMBL4827218 0.91 TYMP (0.45) TYMPADORA2AADORA2BADORA1
SCHEMBL7882460 0.89 TYMP (0.49) TYMPPOLBADORA1
SCHEMBL4826069 0.87 TYMP (0.58) TYMPADORA1
SCHEMBL532674 0.87 TYMP (0.58) TYMPADORA1
SCHEMBL6905301 0.87 TYMP (0.58) TYMPADORA1
SCHEMBL2239678 0.87 TYMP (0.58) TYMPADORA1
SCHEMBL30549354 0.87 SLC29A1 (0.43) TYMPPOLB
SCHEMBL21828804 0.87 SLC29A1 (0.43) TYMPPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415776-B1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B NOVARTIS AG (CH) 2016-05-25 EP disclosed
US-9290533-B2 β-L-2′-deoxy-nucleosides for the treatment of hepatitis B NOVARTIS AG (CH) 2016-03-22 US disclosed
EP-1431304-B1 Beta - L-2'-Deoxy-Nucleosides for the treatment of Hepatitis B NOVARTIS AG (CH) 2014-12-03 EP disclosed
US-20130324491-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B IDENIX PHARMACEUTICALS, INC. (US) 2013-12-05 US disclosed
EP-2415776-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B IDENIX Pharmaceuticals, Inc. (US) 2012-02-08 EP disclosed
US-20110257120-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B IDENIX PHARMACEUTICALS, INC. (US) 2011-10-20 US disclosed
US-20110195922-A9 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2011-08-11 US disclosed
US-7795238-B2 β-L-2′-deoxy-nucleosides for the treatment of hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2010-09-14 US disclosed
US-20080188440-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2008-08-07 US disclosed
US-7304043-B2 β-L-2′-deoxy-nucleosides for the treatment of hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2007-12-04 US disclosed
EP-1104436-B1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B VIRUS IDENIX CAYMAN LTD (KY) 2005-12-21 EP disclosed
US-6946450-B2 β-L-2′-deoxy-nucleosides for the treatment of hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2005-09-20 US disclosed
EP-1292313-B1 METHODS FOR TREATING HEPATITIS DELTA VIRUS INFECTION WITH BETA-L-2' DEOXY-NUCLEOSIDES IDENIX CAYMAN LTD (KY) 2004-09-08 EP disclosed
US-6787526-B1 AND INTERFERON IDENIX PHARMACEUTICALS, INC. 2004-09-07 US disclosed
EP-1431304-A2 Beta - L-2'-Deoxy-Nucleosides for the treatment of Hepatitis B Idenix (Cayman) Limited (KY) 2004-06-23 EP disclosed
US-20030225028-A1 2'-deoxy-beta-L-erythropentofuranonucleoside or a salt or prodrug thereof GOSSELIN GILLES (FR) 2003-12-04 US disclosed
US-20030220290-A1 Beta-L-2'-deoxy-nucleosides for the treatment of hepatitis B CENTRE NATIONAL DA LA RESERCHE SCIENTIFIQUE 2003-11-27 US disclosed
US-6566344-B1 Administering beta-L-2'-deoxycytidine compound for therapy of hepatitis B virus infection IDENIX PHARMACEUTICALS, INC. 2003-05-20 US disclosed
US-6444652-B1 β-L-2'-deoxy-nucleosides for the treatment of hepatitis B NOVIRIO PHARMACEUTICALS LIMITED (CY) 2002-09-03 US disclosed
US-6395716-B1 Antivirals such as telbivudine NOVIRIO PHARMACEUTICALS LIMITED (KY) 2002-05-28 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 (6 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-20110257120-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B PNP, DUT, ATIC TYMP 9/4885ADORA2A 102/4885ADORA2B 93/4885
US-20030225028-A1 2'-deoxy-beta-L-erythropentofuranonucleoside or a salt or prodrug thereof ATIC, DUT, GART TYMP 7/4885ADORA2A 191/4885ADORA2B 245/4885
US-20130324491-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B PNP, DUT, ATIC TYMP 9/4885ADORA2A 102/4885ADORA2B 93/4885
US-20080188440-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC TYMP 9/4885ADORA2A 102/4885ADORA2B 93/4885
US-20110195922-A9 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC TYMP 9/4885ADORA2A 102/4885ADORA2B 93/4885
US-20030220290-A1 Beta-L-2'-deoxy-nucleosides for the treatment of hepatitis B DUT, PNP, ATIC TYMP 7/4885ADORA2A 131/4885ADORA2B 118/4885

“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.