SCHEMBL7677302

SCHEMBL7677302

CS(=O)(=O)c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.62
ENPP2 Q13822 2/20 0.62
KIF11 P52732 1/20 0.53
CA12 O43570 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52
PTGS1 P23219 1/20 0.52

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
SCHEMBL10300269 1.00 PTGS2 (0.62) PTGS2ENPP2KIF11CA12CA2
SCHEMBL2376239 0.90 ENPP2 (0.72) PTGS2ENPP2
SCHEMBL8770202 0.89 PTGS2 (0.79) PTGS2CA12CA2CA9PTGS1
SCHEMBL1687503 0.89 PTGS2 (0.79) PTGS2CA12CA2CA9PTGS1
SCHEMBL12341698 0.89 PTGS2 (0.68) PTGS2PTGS1
SCHEMBL15771185 0.87 ENPP2 (0.56) PTGS2ENPP2KIF11
SCHEMBL5052857 0.87 PTGS2 (0.74) PTGS2KIF11PTGS1
SCHEMBL7395459 0.87 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL6470141 0.87 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL10058341 0.87 PTGS2 (0.52) PTGS2ENPP2KIF11PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140113093-A1 Polymers with reduced estrogenic activity SOLVAY SPECIALITY POLYMERS USA, LLC (US) 2014-04-24 US disclosed
US-20140113093-A1 Polymers with reduced estrogenic activity SOLVAY SPECIALITY POLYMERS USA, LLC (US) 2014-04-24 US disclosed
US-8648094-B2 IAP BIR domain binding compounds PHARMASCIENCE, INC. (CA) 2014-02-11 US disclosed
WO-2012160172-A1 POLYMERS WITH REDUCED ESTROGENIC ACTIVITY SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2012-11-29 WO disclosed
US-20120195915-A1 IAP BIR domain binding compounds PHARMASCIENCE INC. (CA) 2012-08-02 US disclosed
EP-1320785-B1 OXIME DERIVATIVES AND THE USE THEREOF AS LATENT ACIDS BASF SE (DE) 2010-02-17 EP disclosed
US-7250483-B2 Inhibition of catalytically active impurities in polycarbonate by the melt transesterification process BAYER MATERIALSCIENCE AG (DE) 2007-07-31 US disclosed
US-7244544-B2 Oxime derivatives and the use thereof as latent acids CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-07-17 US disclosed
US-7244544-B2 Oxime derivatives and the use thereof as latent acids CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-07-17 US disclosed
US-20020007060-A1 Reverse hydroxamate inhibitors of matrix metalloproteinases DAVIDSEN STEVEN K (US) 2002-01-17 US disclosed
US-6294573-B1 FOR THERAPY RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, OSTEOPENIAS SUCH AS OSTEOPOROSIS, PERIODONTITIS, GINGIVITIS, CORNEAL, EPIDERMAL OR GASTRIC ULCERATION, AND TUMOR GROWTH AND METASTASIS OR INVASION ABBOTT LABORATORIES 2001-09-25 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-20120195915-A1 IAP BIR domain binding compounds BIRC5, BIRC2, BIRC3 PTGS2 4275/4885ENPP2 1514/4885KIF11 2050/4885
US-20020007060-A1 Reverse hydroxamate inhibitors of matrix metalloproteinases MMP1, MMP9, MMP3 PTGS2 199/4885ENPP2 626/4885KIF11 3968/4885

“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.