SCHEMBL3453513

SCHEMBL3453513

Cc1ncc(-c2ccc(S(=O)(=O)O)s2)s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
KDM4E B2RXH2 2/20 0.40
HCAR2 Q8TDS4 1/20 0.37
PIK3CD O00329 4/20 0.35
PIK3CB P42338 4/20 0.35
PIK3CG P48736 4/20 0.35
PIK3C3 Q8NEB9 4/20 0.35
POLB P06746 1/20 0.35
PTGS2 P35354 1/20 0.34
GCK P35557 2/20 0.34
GCKR Q14397 2/20 0.34
MAPT P10636 2/20 0.33
TP53 P04637 1/20 0.33
CA4 P22748 1/20 0.33
CA7 P43166 1/20 0.33
PIK3CA P42336 2/20 0.32
MTOR P42345 2/20 0.32

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
SCHEMBL9198944 0.78 L3MBTL1 (0.34) CA1CA2CA12CA9KDM4E
SCHEMBL20175445 0.78 HCAR2 (0.40) KDM4EHCAR2PIK3CDPIK3CBPIK3CG
SCHEMBL15865702 0.76 HCAR2 (0.45) CA1CA2CA12CA9KDM4E
Hydrochloric Acid SCHEMBL28145192 0.74 HCAR2 (0.44) KDM4EHCAR2
SCHEMBL10442133 0.74 NPC1 (0.39) KDM4EHCAR2PIK3CDPIK3CBPIK3CG
SCHEMBL10442596 0.73 HCAR2 (0.46) HCAR2PIK3CDPIK3CBPIK3CGPIK3C3
SCHEMBL4198555 0.72 KDM4E (0.63) KDM4EPOLBMAPTPFKFB3PFKFB4
SCHEMBL7082340 0.71 MAPT (0.39) CA1CA2CA12CA9KDM4E
SCHEMBL5228998 0.70 PFKFB3 (0.55) CA1CA2CA12CA9KDM4E
SCHEMBL4491981 0.69 MAPT (0.41) MAPT

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7122538-B2 Sulfonamide derivatives as antipsychotic agents GLAXO GROUP LIMITED (GB) 2006-10-17 US claimed
EP-1549639-B1 SULPHONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LTD (GB) 2006-05-24 EP claimed
US-20060063757-A1 Sulfonamide derivatives as antipsychotic agents GLAXO GROUP LIMITED (GB) 2006-03-23 US claimed
EP-1549639-A1 SULPHONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2005-07-06 EP claimed
WO-2004031181-A1 SULFONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2004-04-15 WO claimed
US-20100273849-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2010-10-28 US disclosed
EP-1370537-B1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2010-10-13 EP disclosed
US-7666892-B2 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2010-02-23 US disclosed
US-20080262045-A1 Metalloproteinase Inhibitors ASTRAZENECA AB (SE) 2008-10-23 US disclosed
US-7368465-B2 Respiratory system disorders; antiarthritic agents; anticancer agents; bone disorders ASTRAZENECA AB (SE) 2008-05-06 US disclosed
US-7122538-B2 Sulfonamide derivatives as antipsychotic agents GLAXO GROUP LIMITED (GB) 2006-10-17 US disclosed
EP-1549639-B1 SULPHONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LTD (GB) 2006-05-24 EP disclosed
EP-1549639-A1 SULPHONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2005-07-06 EP disclosed
US-20040147573-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-29 US disclosed
US-20040138276-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-15 US disclosed
WO-2004031181-A1 SULFONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2004-04-15 WO disclosed
EP-1370536-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
EP-1370537-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
WO-2002074750-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO disclosed
WO-2002074751-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 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 (5 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-20100273849-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP11 CA1 246/4885CA2 139/4885CA12 133/4885
US-20080262045-A1 Metalloproteinase Inhibitors MMP9, MMP12, MMP11 CA1 246/4885CA2 139/4885CA12 133/4885
US-20060063757-A1 Sulfonamide derivatives as antipsychotic agents SIGMAR1, CHRM1, NPSR1 CA1 175/4885CA2 598/4885CA12 811/4885
US-20040138276-A1 Metalloproteinase inhibitors MMP9, MMP11, MMP7 CA1 335/4885CA2 199/4885CA12 257/4885
US-20040147573-A1 Metalloproteinase inhibitors MMP12, MMP7, MMP10 CA1 134/4885CA2 146/4885CA12 415/4885

“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.