SCHEMBL2632480

SCHEMBL2632480

O=C(OC[C@@H]1O[C@H](n2cc(I)c(=O)[nH]c2=O)CC1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.65
TK1 P04183 1/20 0.51
BCHE P06276 2/20 0.47
POLB P06746 2/20 0.47
TYMS P04818 2/20 0.45
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
KMT2A Q03164 1/20 0.44
UPP1 Q16831 1/20 0.42
PPM1B O75688 1/20 0.40

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
SCHEMBL6842685 1.00 RNASE1 (0.65) RNASE1TK1BCHEPOLBTYMS
SCHEMBL2623807 1.00 RNASE1 (0.65) RNASE1TK1BCHEPOLBTYMS
SCHEMBL13273272 1.00 RNASE1 (0.65) RNASE1TK1BCHEPOLBTYMS
SCHEMBL7653783 1.00 RNASE1 (0.65) RNASE1TK1BCHEPOLBTYMS
SCHEMBL30698170 0.91 RNASE1 (0.61) RNASE1TK1BCHETYMSUPP1
SCHEMBL6542150 0.91 RNASE1 (0.61) RNASE1TK1BCHETYMSUPP1
SCHEMBL22992340 0.89 RNASE1 (0.82) RNASE1TK1
SCHEMBL9326675 0.89 RNASE1 (0.82) RNASE1TK1
SCHEMBL13273344 0.89 RNASE1 (0.68) RNASE1POLBTYMS
SCHEMBL21886791 0.89 RNASE1 (0.82) RNASE1TK1

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 27 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
EP-1572095-B1 BETA-L-2'-DEOXYNUCLEOSIDES FOR USE IN THE TREATMENT OF RESISTANT HBV STRAINS NOVARTIS AG (CH) 2015-06-10 EP disclosed
EP-1431304-B1 Beta - L-2'-Deoxy-Nucleosides for the treatment of Hepatitis B NOVARTIS AG (CH) 2014-12-03 EP disclosed
EP-2607370-A2 Amorphous form of beta- L-2'-deoxythymidine Novartis AG (CH) 2013-06-26 EP disclosed
US-20120264707-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B IDENIX PHARMACEUTICALS, INC. (US) 2012-10-18 US disclosed
US-8158606-B2 β-L-2′-deoxynucleosides for the treatment of resistant HBV strains and combination therapies NOVARTIS, AG (CH) 2012-04-17 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-20110172178-A1 BETA-L-2' DEOXYNUCLEOSIDES FOR THE TREATMENT OF RESISTANT HBV STRAINS AND COMBINATION THERAPIES NOVARTIS AG (CH) 2011-07-14 US disclosed
US-20100048504-A1 CRYSTALLINE AND AMORPHOUS FORMS OF BETA-L-DEOXYTHYMIDINE NOVARTIS AG (CH) 2010-02-25 US disclosed
US-7589079-B2 Crystalline and amorphous forms of beta-L-2′-deoxythymidine NOVARTIS AG (CH) 2009-09-15 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-20080182814-A1 Beta-L-2'-deoxynucleosides for the treatment of resistant HBV strains and combination therapies IDENIX PHARMACEUTICALS INC. 2008-07-31 US disclosed
US-20080182814-A1 Beta-L-2'-deoxynucleosides for the treatment of resistant HBV strains and combination therapies IDENIX PHARMACEUTICALS INC. 2008-07-31 US disclosed
US-7323451-B2 Crystalline and amorphous forms of beta-L-2′-deoxythymidine IDENIX PHARMACEUTICALS, INC. (US) 2008-01-29 US disclosed
US-7323451-B2 Crystalline and amorphous forms of beta-L-2′-deoxythymidine IDENIX PHARMACEUTICALS, INC. (US) 2008-01-29 US disclosed
US-20080015350-A1 Crystalline and amorphous forms of beta-L-2'-deoxythymidine NOVARTIS AG (CH) 2008-01-17 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
US-20070087995-A1 beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B IDENIX PHARMACEUTICALS, INC. (US) 2007-04-19 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 (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-20070087995-A1 beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC RNASE1 473/4885TK1 34/4885BCHE 1464/4885
US-20110257120-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B PNP, DUT, ATIC RNASE1 473/4885TK1 34/4885BCHE 1464/4885
US-20110172178-A1 BETA-L-2' DEOXYNUCLEOSIDES FOR THE TREATMENT OF RESISTANT HBV STRAINS AND COMBINATION THERAPIES SLC28A2, SLC29A2, PNP RNASE1 1059/4885TK1 147/4885BCHE 477/4885
US-20080015350-A1 Crystalline and amorphous forms of beta-L-2'-deoxythymidine TYMP, PYGL, TTR RNASE1 41/4885TK1 93/4885BCHE 637/4885
US-20080182814-A1 Beta-L-2'-deoxynucleosides for the treatment of resistant HBV strains and combination therapies SLC28A2, SLC28A1, SLC29A2 RNASE1 927/4885TK1 161/4885BCHE 482/4885
US-20080188440-A1 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC RNASE1 473/4885TK1 34/4885BCHE 1464/4885
US-20100048504-A1 CRYSTALLINE AND AMORPHOUS FORMS OF BETA-L-DEOXYTHYMIDINE TYMP, PYGL, TTR RNASE1 50/4885TK1 91/4885BCHE 642/4885
US-20110195922-A9 Beta-L-2'-Deoxy-Nucleosides for the Treatment of Hepatitis B PNP, DUT, ATIC RNASE1 473/4885TK1 34/4885BCHE 1464/4885
US-20120264707-A1 BETA-L-2'-DEOXY-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B PNP, DUT, ATIC RNASE1 473/4885TK1 34/4885BCHE 1464/4885

“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.