SCHEMBL6728189

SCHEMBL6728189

CS(=O)(=O)c1cc(F)c(-c2cnccc2-c2ccc(C#N)cc2)cc1F

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 8/20 0.52
PTGS2 P35354 1/20 0.46
CYP11B2 P19099 2/20 0.40
CYP11B1 P15538 1/20 0.40
RPS6KA3 P51812 5/20 0.38
GCGR P47871 1/20 0.37
MAPK14 Q16539 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
CYP17A1 P05093 1/20 0.36

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
SCHEMBL6728713 0.88 SLC22A12 (0.47) SLC22A12PTGS2CYP11B2CYP11B1RPS6KA3
SCHEMBL7110797 0.87 SLC22A12 (0.53) SLC22A12PTGS2CYP11B2CYP11B1RPS6KA3
SCHEMBL6732701 0.87 PTGS2 (0.50) SLC22A12PTGS2RPS6KA3MAPK14CYP17A1
SCHEMBL6734300 0.85 RPS6KA3 (0.53) SLC22A12PTGS2RPS6KA3CYP17A1
SCHEMBL6736510 0.84 PTGS2 (0.45) SLC22A12PTGS2CYP11B2CYP11B1RPS6KA3
SCHEMBL6733436 0.84 PTGS2 (0.45) SLC22A12PTGS2CYP11B2CYP11B1RPS6KA3
SCHEMBL6732643 0.84 PTGS2 (0.48) SLC22A12PTGS2RPS6KA3CYP17A1
SCHEMBL6737143 0.84 PTGS2 (0.48) SLC22A12PTGS2RPS6KA3CYP17A1
SCHEMBL6739704 0.84 RPS6KA3 (0.50) SLC22A12PTGS2RPS6KA3CYP17A1
SCHEMBL6730142 0.83 PTGS2 (0.49) SLC22A12PTGS2RPS6KA3

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 SLC22A12 4211/4885PTGS2 10/4885CYP11B2 573/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 SLC22A12 4211/4885PTGS2 10/4885CYP11B2 573/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 SLC22A12 4211/4885PTGS2 10/4885CYP11B2 573/4885

“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.