SCHEMBL6728232

SCHEMBL6728232

Cc1cccc(-c2noc(CF)c2-c2cc(F)c(S(C)(=O)=O)c(F)c2)n1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.39
TGFBR1 P36897 7/20 0.35
THRB P10828 3/20 0.35
CASP1 P29466 1/20 0.33
MAPK14 Q16539 3/20 0.32
GHSR Q92847 1/20 0.32
KDR P35968 2/20 0.31
CCR1 P32246 1/20 0.31
CCR8 P51685 1/20 0.31
KMT2A Q03164 1/20 0.31
RIPK2 O43353 1/20 0.30
CYP2A6 P11509 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL6736570 0.91 PTGS2 (0.39) PTGS2TGFBR1THRBCASP1MAPK14
SCHEMBL6734685 0.91 PTGS2 (0.46) PTGS2TGFBR1THRBCCR1CCR8
SCHEMBL6726466 0.88 TGFBR1 (0.40) PTGS2TGFBR1THRBMAPK14GHSR
SCHEMBL6739174 0.87 PTGS2 (0.44) PTGS2TGFBR1THRBCASP1CCR1
SCHEMBL6734889 0.83 TGFBR1 (0.35) PTGS2TGFBR1THRBCASP1MAPK14
SCHEMBL6729919 0.83 PTGS2 (0.46) PTGS2THRBMAPK14ALDH1A1
SCHEMBL7111808 0.82 TGFBR1 (0.40) PTGS2TGFBR1THRBMAPK14GHSR
SCHEMBL6721372 0.82 PTGS2 (0.47) PTGS2TGFBR1THRBGHSR
SCHEMBL6732513 0.82 PTGS2 (0.58) PTGS2ALDH1A1
SCHEMBL6732254 0.82 PTGS2 (0.49) PTGS2ALDH1A1

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 10/4885TGFBR1 1183/4885THRB 2837/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885TGFBR1 1183/4885THRB 2837/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885TGFBR1 1183/4885THRB 2837/4885

“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.