SCHEMBL4306018

SCHEMBL4306018

COC1O[C@H](COS(=O)(=O)c2ccc(C)cc2)[C@H](OS(=O)(=O)c2ccc(C)cc2)[C@H]1OC(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 5/20 0.47
LGALS4 P56470 4/20 0.47
PTPN1 P18031 7/20 0.38
HPSE Q9Y251 2/20 0.38
MMP9 P14780 1/20 0.38
MMP12 P39900 1/20 0.38
CYP3A4 P08684 2/20 0.37
VEGFA P15692 1/20 0.37
LGALS9 O00182 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
FGF1 P05230 1/20 0.36
FGF2 P09038 1/20 0.36

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
SCHEMBL5680059 0.94 LGALS3 (0.49) LGALS3LGALS4PTPN1MMP9MMP12
SCHEMBL1775668 0.86 NT5E (0.47) LGALS3LGALS4PTPN1HPSEVEGFA
SCHEMBL18408882 0.85 HPSE (0.50) HPSEVEGFAFGF1FGF2
SCHEMBL7155559 0.85 HPSE (0.50) HPSEVEGFAFGF1FGF2
SCHEMBL7155560 0.85 HPSE (0.50) HPSEVEGFAFGF1FGF2
SCHEMBL7149766 0.84 HPSE (0.52) HPSEVEGFAFGF1FGF2
SCHEMBL7149771 0.84 HPSE (0.52) HPSEVEGFAFGF1FGF2
SCHEMBL7150252 0.83 CA1 (0.44) LGALS3MMP9MMP12CYP3A4CA1
SCHEMBL1777133 0.82 NT5E (0.43) LGALS3LGALS4PTPN1HPSEVEGFA
SCHEMBL7154478 0.82 CA1 (0.40) LGALS3LGALS4CYP3A4LGALS9CA12

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511027-B2 Method of treating hepatitis delta virus infection GEORGETOWN UNIVERSITY (US) 2009-03-31 US disclosed
EP-1284720-B1 L-FMAU FOR THE TREATMENT OF HEPATITIS DELTA VIRAL INFECTION UNIV GEORGETOWN (US) 2006-09-13 EP disclosed
EP-1283211-B1 L-Nucleosides for the treatment of hepatitis B-virus and Epstein-barr virus UNIV GEORGIA RES FOUND (US) 2006-06-07 EP disclosed
US-6670342-B2 Administering a nucleoside or a nucleoside analog that suppresses the expression of the hepatitis B surface or preS1 antigen; 2'-fluoro-5-methyl-beta-L-arabinofuranosyl-uridine (L-FMAU) GEORGETOWN UNIVERSITY 2003-12-30 US disclosed
US-20030158149-A1 Method of treating hepatitis delta virus infection CASEY JOHN L (US) 2003-08-21 US disclosed
EP-0748330-B1 L-NUCLEOSIDES FOR THE TREATMENT OF HEPATITIS B-VIRUS AND EPSTEIN-BAR VIRUS UNIV GEORGIA RES FOUND (US) 2003-04-02 EP disclosed
EP-1283211-A2 L-Nucleosides for the treatment of hepatitis B-virus and Epstein-barr virus THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2003-02-12 EP disclosed
US-20020160980-A1 Method of treating hepatitis delta virus infection UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC 2002-10-31 US disclosed
US-5808040-A VIRICIDES YALE UNIVERSITY (US) 1998-09-15 US disclosed
US-5753789-A Oligonucleotides containing L-nucleosides YALE UNIVERSITY (US) 1998-05-19 US disclosed
US-5587362-A VIRICIDES FOR HEPATITIS VIRUS AND EPSTEIN-BAR VIRUS UNIV. OF GA RESEARCH FOUNDATION (US) 1996-12-24 US disclosed
US-5567688-A ADMINISTERING SPECIFIED ENANTIOMORPH TO HUMAN INFECTED WITH HEPATITIS B VIRUS UNIV. OF GA RESEARCH FOUNDATION (US) 1996-10-22 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 (2 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-20030158149-A1 Method of treating hepatitis delta virus infection NSUN3, METTL3, METAP1 LGALS3 692/4885LGALS4 2141/4885PTPN1 1693/4885
US-20020160980-A1 Method of treating hepatitis delta virus infection NSUN3, METTL3, METAP1 LGALS3 692/4885LGALS4 2141/4885PTPN1 1693/4885

“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.