SCHEMBL532930

SCHEMBL532930

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1O

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 1/20 0.71
P2RX3 P56373 2/20 0.65
P2RX4 Q99571 2/20 0.65
P2RX2 Q9UBL9 2/20 0.65
ABCB1 P08183 1/20 0.65
GSK3A P49840 2/20 0.65
RPS6KA3 P51812 2/20 0.65
MAPK14 Q16539 2/20 0.65
P2RX6 O15547 1/20 0.60
P2RX1 P51575 1/20 0.60
P2RX5 Q93086 1/20 0.60
P2RY11 Q96G91 1/20 0.60
P2RX7 Q99572 1/20 0.60
LMNA P02545 1/20 0.60
AHCY P23526 1/20 0.56
ADORA1 P30542 2/20 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
SCHEMBL5794949 1.00 ENPP1 (0.71) ENPP1P2RX3P2RX4P2RX2ABCB1
SCHEMBL5983100 1.00 ENPP1 (0.71) ENPP1P2RX3P2RX4P2RX2ABCB1
SCHEMBL532929 1.00 ENPP1 (0.71) ENPP1P2RX3P2RX4P2RX2ABCB1
SCHEMBL12352429 0.93 P2RX3 (0.75) ENPP1P2RX3P2RX4P2RX2ABCB1
SCHEMBL9189337 0.93 P2RX3 (0.75) ENPP1P2RX3P2RX4P2RX2ABCB1
SCHEMBL13169185 0.93 P2RX3 (0.75) ENPP1P2RX3P2RX4P2RX2ABCB1
SCHEMBL12243789 0.93 P2RX3 (0.75) ENPP1P2RX3P2RX4P2RX2ABCB1
SCHEMBL441535 0.91 ABCB1 (0.77) ABCB1GSK3ARPS6KA3MAPK14P2RY11
SCHEMBL11644877 0.91 ABCB1 (0.77) ABCB1GSK3ARPS6KA3MAPK14P2RY11
SCHEMBL12222452 0.90 P2RX3 (0.64) ENPP1P2RX3P2RX4P2RX2ABCB1

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 28 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-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-20080188440-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2008-08-07 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-20020035085-A1 Administering a 2'-deoxy-beta-L-erythro-pentofuranonucleoside or a pharmaceutically acceptable salt or prodrug thereof DCTD, DUT, DPYD ENPP1 32/4885P2RX3 2900/4885P2RX4 3045/4885
US-20030225028-A1 2'-deoxy-beta-L-erythropentofuranonucleoside or a salt or prodrug thereof ATIC, DUT, GART ENPP1 35/4885P2RX3 1836/4885P2RX4 2236/4885
US-20100152126-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC ENPP1 49/4885P2RX3 1266/4885P2RX4 1776/4885
US-20130324491-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B PNP, DUT, ATIC ENPP1 49/4885P2RX3 1266/4885P2RX4 1776/4885
US-20080188440-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC ENPP1 49/4885P2RX3 1266/4885P2RX4 1776/4885
US-20110195922-A9 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC ENPP1 49/4885P2RX3 1266/4885P2RX4 1776/4885
US-20120264707-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B PNP, DUT, ATIC ENPP1 49/4885P2RX3 1266/4885P2RX4 1776/4885
US-20030220290-A1 Beta-L-2'-deoxy-nucleosides for the treatment of hepatitis B DUT, PNP, ATIC ENPP1 40/4885P2RX3 1528/4885P2RX4 2004/4885

“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.