SCHEMBL2349008

SCHEMBL2349008

NS(=O)(=O)c1cc(Br)c(Cl)s1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.42
CA2 P00918 17/20 0.41
RAD51 Q06609 1/20 0.41
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38
PTGES2 Q9H7Z7 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
SCHEMBL388122 0.83 FBP1 (0.42) FBP1CA2RAD51CA1CA9
SCHEMBL2914595 0.81 FBP1 (0.44) FBP1RAD51PTGES2
SCHEMBL1938334 0.80 CA2 (0.44) CA2CA1CA9PTGES2
SCHEMBL1137322 0.80 PTGES2 (0.53) CA2CA1CA9PTGES2
Hydrochloric Acid SCHEMBL27779742 0.79 FBP1 (0.43) FBP1RAD51
SCHEMBL5524092 0.77 CA2 (0.44) CA2CA1CA9
SCHEMBL2345395 0.77 CA2 (0.41) CA2CA1CA9PTGES2
SCHEMBL12203728 0.77 DAO (0.42) CA2PTGES2
SCHEMBL1510259 0.76 FBP1 (0.48) FBP1CA2RAD51CA1CA9
SCHEMBL7509729 0.75 CA2 (0.41) CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506000-B9 HETEROCYCLICSULFONAMIDE HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-08-31 EP disclosed
EP-1506000-B1 HETEROCYCLICSULFONAMIDE HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2010-09-15 EP disclosed
US-20090227555-A2 Novel Pyridine Compounds ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-20090227555-A2 Novel Pyridine Compounds ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-20090227555-A2 Novel Pyridine Compounds ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-20090042852-A1 Novel Pyridine Compounds ASTRAZENECA AB (SE) 2009-02-12 US disclosed
US-20090042852-A1 Novel Pyridine Compounds ASTRAZENECA AB (SE) 2009-02-12 US disclosed
US-20090042852-A1 Novel Pyridine Compounds ASTRAZENECA AB (SE) 2009-02-12 US disclosed
CN-101137643-A Novel pyridine compounds ASTRAZENECA AB (SE) 2008-03-05 CN disclosed
EP-1836189-A1 NOVEL PYRIDINE COMPOUNDS AstraZeneca AB (SE) 2007-09-26 EP disclosed
WO-2006073361-A9 NOVEL PYRIDINE COMPOUNDS ASTRAZENECA AB (SE) 2007-08-02 WO disclosed
WO-2006073361-A1 NOVEL PYRIDINE COMPOUNDS ASTRAZENECA AB (SE) 2006-07-13 WO disclosed
EP-1506000-A4 HETEROCYCLICSULFONAMIDE HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2005-06-15 EP disclosed
US-6869964-B2 Heterocyclicsulfonamide hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2005-03-22 US disclosed
EP-1506000-A1 HETEROCYCLICSULFONAMIDE HEPATITIS C VIRUS INHIBITORS Bristol-Myers Squibb Company (US) 2005-02-16 EP disclosed
US-20040072761-A1 Heterocyclicsulfonamide hepatitis C virus inhibitors CAMPBELL JEFFREY ALLEN (US) 2004-04-15 US disclosed
WO-2003099316-A1 HETEROCYCLICSULFONAMIDE HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-12-04 WO 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 (3 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-20040072761-A1 Heterocyclicsulfonamide hepatitis C virus inhibitors HCCS, ANPEP, DNPEP FBP1 1966/4885CA2 4339/4885RAD51 4733/4885
US-20090042852-A1 Novel Pyridine Compounds P2RY12, P2RY11, P2RY1 FBP1 734/4885CA2 2671/4885RAD51 3784/4885
US-20090227555-A2 Novel Pyridine Compounds P2RY12, P2RY1, P2RY11 FBP1 243/4885CA2 3705/4885RAD51 3389/4885

“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.