SCHEMBL6736962

SCHEMBL6736962

CS(=O)(=O)c1c(F)cc(-c2c(-c3ccc(Cl)cc3)noc2C(F)F)cc1F

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.44
NPSR1 Q6W5P4 3/20 0.38
MCOLN3 Q8TDD5 2/20 0.38
CSNK1D P48730 2/20 0.38
MAPK14 Q16539 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK9 P45984 1/20 0.38
MAPK10 P53779 1/20 0.38
CASP1 P29466 1/20 0.37
MAPK1 P28482 1/20 0.37
MAPT P10636 2/20 0.35
GAA P10253 1/20 0.35
NR1H4 Q96RI1 1/20 0.33

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
SCHEMBL6734119 0.91 PTGS2 (0.40) PTGS2CSNK1DMAPK14MAPK9MAPK10
SCHEMBL6736228 0.91 PTGS2 (0.38) PTGS2CSNK1DMAPK14MAPK9MAPK10
SCHEMBL6731928 0.91 CASP1 (0.39) PTGS2CSNK1DMAPK14MAPK9MAPK10
SCHEMBL6732859 0.91 PTGS2 (0.43) PTGS2NPSR1MCOLN3CSNK1DMAPK14
SCHEMBL6734418 0.91 PTGS2 (0.49) PTGS2CSNK1DMAPK14MAPK9MAPK10
SCHEMBL6739318 0.89 PTGS2 (0.40) PTGS2CSNK1DMAPK14MAPK9MAPK10
SCHEMBL6729625 0.89 PTGS2 (0.42) PTGS2NPSR1CSNK1DMAPK14MAPK9
SCHEMBL6728980 0.88 PTGS2 (0.39) PTGS2NPSR1MCOLN3CSNK1DMAPK14
SCHEMBL6729683 0.88 PTGS2 (0.44) PTGS2CSNK1DMAPK14ALDH1A1MAPK9
SCHEMBL6736964 0.88 PTGS2 (0.44) PTGS2NPSR1ALDH1A1CASP1GAA

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.