SCHEMBL6735626

SCHEMBL6735626

CS(=O)(=O)c1c(F)cc(-c2c(-c3ccc(Cl)cc3)noc2CO)cc1F

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.46
NPSR1 Q6W5P4 3/20 0.39
MCOLN3 Q8TDD5 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CASP1 P29466 1/20 0.39
MAPK1 P28482 1/20 0.39
PTGS1 P23219 2/20 0.38
PDE3A Q14432 1/20 0.38
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
NOTUM Q6P988 2/20 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
SCHEMBL6735988 0.91 PTGS2 (0.40) PTGS2CASP1PTGS1PDE3A
SCHEMBL6732792 0.91 PTGS2 (0.46) PTGS2CASP1PTGS1PDE3A
SCHEMBL6729759 0.91 PTGS2 (0.48) PTGS2PTGS1PDE3A
SCHEMBL6732522 0.91 PTGS2 (0.48) PTGS2PTGS1PDE3A
SCHEMBL6739965 0.90 PTGS2 (0.47) PTGS2CASP1PTGS1PDE3A
SCHEMBL6735771 0.90 PTGS2 (0.47) PTGS2NPSR1MCOLN3ALDH1A1CASP1
SCHEMBL6737160 0.89 PTGS2 (0.42) PTGS2NPSR1CASP1PTGS1PDE3A
SCHEMBL6739850 0.89 PTGS2 (0.55) PTGS2NPSR1MCOLN3ALDH1A1MAPK1
SCHEMBL6732715 0.88 PTGS2 (0.57) PTGS2NPSR1MCOLN3ALDH1A1PTGS1
SCHEMBL6728527 0.88 PTGS2 (0.45) PTGS2CASP1PTGS1PDE3A

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-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-07-15 US claimed
US-6673818-B2 TREATING CYCLOOXYGENASE-2 MEDIATED DISORDERS, SUCH AS ARTHRITIS, PAIN, FEVER AND CANCER PHARMACIA CORPORATION 2004-01-06 US claimed
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-08-07 US claimed
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-02-13 US claimed
EP-1251126-A2 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation Pharmacia Corporation (US) 2002-10-23 EP 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 10/4885NPSR1 533/4885MCOLN3 3839/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885NPSR1 533/4885MCOLN3 3839/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885NPSR1 533/4885MCOLN3 3839/4885

“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.