SCHEMBL6733532

SCHEMBL6733532

COc1cc(-c2ccncc2-c2cc(F)c(S(C)(=O)=O)cc2F)ccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 9/20 0.45
PTGS1 P23219 1/20 0.39
SCN9A Q15858 8/20 0.39
CYP2C9 P11712 1/20 0.39
RPS6KA3 P51812 2/20 0.38

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
SCHEMBL6740004 0.92 PTGS2 (0.56) PTGS2PTGS1SCN9A
SCHEMBL7112230 0.89 RPS6KA3 (0.45) PTGS2PTGS1SCN9ARPS6KA3
SCHEMBL6736993 0.88 SCN9A (0.45) PTGS2SCN9ARPS6KA3
SCHEMBL6736806 0.86 PTGS2 (0.53) PTGS2PTGS1SCN9ACYP2C9RPS6KA3
SCHEMBL6734486 0.84 PTGS2 (0.53) PTGS2PTGS1SCN9ARPS6KA3
SCHEMBL6737143 0.83 PTGS2 (0.48) PTGS2PTGS1RPS6KA3
SCHEMBL6739983 0.83 RPS6KA3 (0.47) PTGS2PTGS1SCN9ARPS6KA3
SCHEMBL6730142 0.82 PTGS2 (0.49) PTGS2RPS6KA3
SCHEMBL6735046 0.81 PTGS2 (0.43) PTGS2PTGS1RPS6KA3
SCHEMBL7046028 0.81 PTGS2 (0.55) PTGS2PTGS1SCN9ARPS6KA3

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 PTGS2 10/4885PTGS1 4/4885SCN9A 4450/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885PTGS1 4/4885SCN9A 4450/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885PTGS1 4/4885SCN9A 4450/4885

“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.