SCHEMBL532594

SCHEMBL532594

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

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
LMNA P02545 1/20 0.40
ADORA2A P29274 2/20 0.39
ADORA2B P29275 2/20 0.39
ADORA1 P30542 1/20 0.38
TYMP P19971 2/20 0.38
RNASE1 P07998 1/20 0.37
P2RY1 P47900 1/20 0.37
P2RX3 P56373 1/20 0.37
P2RX4 Q99571 1/20 0.37
P2RX2 Q9UBL9 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
SCHEMBL532593 0.93 TYMP (0.46) POLBADORA2AADORA2BADORA1TYMP
SCHEMBL7202899 0.86 ADORA2A (0.41) ADORA2AADORA2BADORA1
SCHEMBL21577261 0.85 TYMP (0.46) POLBADORA2AADORA2BTYMPP2RY1
SCHEMBL9850183 0.84 POLB (0.53) POLBLMNAP2RY1P2RX3P2RX4
SCHEMBL4827218 0.84 TYMP (0.45) ADORA2AADORA2BADORA1TYMPP2RY1
SCHEMBL7882460 0.81 TYMP (0.49) POLBADORA1TYMPP2RY1P2RX3
SCHEMBL14064200 0.81 ADORA3 (0.38) ADORA2AADORA2BADORA1
SCHEMBL532504 0.81 HIF1A (0.53) ADORA1
SCHEMBL21828804 0.80 SLC29A1 (0.43) POLBTYMP
SCHEMBL29674473 0.80 SLC29A1 (0.43) POLBTYMP

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 29 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
US-20120264707-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B IDENIX PHARMACEUTICALS, INC. (US) 2012-10-18 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-20100152126-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2010-06-17 US 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-6596700-B2 Administering a 2'-deoxy-beta-L-erythro-pentofuranonucleoside or a pharmaceutically acceptable salt or prodrug thereof IDENIX PHARMACEUTICALS INC. 2003-07-22 US disclosed
US-6569837-B1 Administering 2'-deoxy-beta-L-erythro-pentofuranonucleoside alone or with another anti-hepatitis B agent such as 3TC (beta-L-2-hydroxymethyl-5-(cytosin-1-yl)-1,3-oxathiolane); use of beta-l-thymidine (telbivudine) IDENIX PHARMACEUTICALS INC. 2003-05-27 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
US-20020035085-A1 Administering a 2'-deoxy-beta-L-erythro-pentofuranonucleoside or a pharmaceutically acceptable salt or prodrug thereof NOVARTIS AG (CH) 2002-03-21 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 (8 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 POLB 65/4885LMNA 1188/4885ADORA2A 102/4885
US-20020035085-A1 Administering a 2'-deoxy-beta-L-erythro-pentofuranonucleoside or a pharmaceutically acceptable salt or prodrug thereof DCTD, DUT, DPYD POLB 207/4885LMNA 1514/4885ADORA2A 409/4885
US-20030225028-A1 2'-deoxy-beta-L-erythropentofuranonucleoside or a salt or prodrug thereof ATIC, DUT, GART POLB 174/4885LMNA 2200/4885ADORA2A 191/4885
US-20100152126-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC POLB 65/4885LMNA 1188/4885ADORA2A 102/4885
US-20130324491-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B PNP, DUT, ATIC POLB 65/4885LMNA 1188/4885ADORA2A 102/4885
US-20110195922-A9 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC POLB 65/4885LMNA 1188/4885ADORA2A 102/4885
US-20120264707-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B PNP, DUT, ATIC POLB 65/4885LMNA 1188/4885ADORA2A 102/4885
US-20030220290-A1 Beta-L-2'-deoxy-nucleosides for the treatment of hepatitis B DUT, PNP, ATIC POLB 77/4885LMNA 1360/4885ADORA2A 131/4885

“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.