SCHEMBL6729466

SCHEMBL6729466

NS(=O)(=O)c1cc(F)c(-c2csc(=O)n2-c2cccc(OC(F)(F)F)c2)cc1F

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 3/20 0.36
KAT6A Q92794 1/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
PIM1 P11309 3/20 0.34
PIM2 Q9P1W9 3/20 0.34
SCN9A Q15858 3/20 0.33
TRPV1 Q8NER1 1/20 0.33
PDE10A Q9Y233 2/20 0.32
SLC22A12 Q96S37 1/20 0.31
ABL1 P00519 1/20 0.31
NOTUM Q6P988 1/20 0.31
ENPP2 Q13822 1/20 0.31

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
SCHEMBL6733725 0.90 KAT6A (0.35) KAT6APIM1PIM2SCN9APDE10A
SCHEMBL6732352 0.90 PTGS2 (0.35) CA1CA2SCN9ATRPV1ENPP2
SCHEMBL6725969 0.86 PTGES2 (0.38) PTGES2KAT6ACA1CA2PIM1
SCHEMBL6732364 0.86 GAA (0.37) PTGES2CA1CA2
SCHEMBL6732538 0.85 CA2 (0.35) PTGES2CA1CA2
SCHEMBL6739469 0.84 PTGS2 (0.39) PTGES2CA1CA2
SCHEMBL6732286 0.83 PTGS2 (0.31)
SCHEMBL6733678 0.83 PTGS2 (0.32) SCN9A
SCHEMBL6734347 0.83 GSK3A (0.38) CA1CA2
SCHEMBL6734523 0.82 PTGS2 (0.43) PTGES2KAT6ACA1CA2PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6699884-B2 ANTIINFLAMMATORY CYCLOOXYGENASE INHIBITORS. PHARMACIA CORPORATION 2004-03-02 US claimed
US-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-07-15 US disclosed
US-6699884-B2 ANTIINFLAMMATORY CYCLOOXYGENASE INHIBITORS. PHARMACIA CORPORATION 2004-03-02 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 PTGES2 8/4885KAT6A 3144/4885CA1 2085/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGES2 8/4885KAT6A 3144/4885CA1 2085/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGES2 8/4885KAT6A 3144/4885CA1 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.