SCHEMBL6837608

SCHEMBL6837608

NS(=O)(=O)c1ccc(F)c(-c2ncccc2-c2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.55
PTGS1 P23219 12/20 0.55
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
KDR P35968 1/20 0.42
EPHB4 P54760 1/20 0.42
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41

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
SCHEMBL6834774 0.90 PTGS2 (0.59) PTGS2PTGS1CA1CA2
SCHEMBL6836475 0.90 PTGS2 (0.59) PTGS2PTGS1CA1CA2
SCHEMBL6838913 0.89 PTGS2 (0.54) PTGS2PTGS1CA1CA2CA12
SCHEMBL6838940 0.88 CA1 (0.51) PTGS2PTGS1CA1CA2CA12
SCHEMBL6838988 0.87 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL6836566 0.87 PTGS2 (0.50) PTGS2PTGS1CA1CA2
SCHEMBL6843475 0.87 CA1 (0.48) PTGS2PTGS1CA1CA2KDR
SCHEMBL6841395 0.87 CA1 (0.50) PTGS2PTGS1CA1CA2CA12
SCHEMBL6839726 0.85 PTGS2 (0.55) PTGS2PTGS1CA1CA2CA12
SCHEMBL6837849 0.85 CA1 (0.48) PTGS2PTGS1CA1CA2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-07-15 US disclosed
US-6673818-B2 TREATING CYCLOOXYGENASE-2 MEDIATED DISORDERS, SUCH AS ARTHRITIS, PAIN, FEVER AND CANCER PHARMACIA CORPORATION 2004-01-06 US disclosed
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-08-07 US disclosed
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-02-13 US disclosed
EP-1251126-A2 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation Pharmacia Corporation (US) 2002-10-23 EP 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-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885PTGS1 4/4885CA1 2085/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885PTGS1 4/4885CA1 2085/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885PTGS1 4/4885CA1 2085/4885

“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.