SCHEMBL6736661

SCHEMBL6736661

CS(=O)(=O)c1c(F)cc(-c2nc(C(F)F)[nH]c2-c2cccc(Br)c2)cc1F

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.39
MAPK13 O15264 1/20 0.39
GCGR P47871 1/20 0.39
MAPK12 P53778 1/20 0.39
MAPK11 Q15759 1/20 0.39
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
ALOX5 P09917 1/20 0.36
KDM4E B2RXH2 1/20 0.35
PTGS2 P35354 5/20 0.34
PTGS1 P23219 3/20 0.33
TYK2 P29597 3/20 0.33
MAOB P27338 1/20 0.32

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
SCHEMBL6740190 0.90 PTGS1 (0.36) MAPK14MAPK11ALDH1A1HPGDALOX5
SCHEMBL6734877 0.89 ALOX5 (0.39) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL6737427 0.89 PTGS2 (0.40) MAPK14MAPK13GCGRMAPK12MAPK11
SCHEMBL6734767 0.88 MAPK14 (0.43) MAPK14ALDH1A1HPGDALOX5KDM4E
SCHEMBL6740226 0.88 HPGD (0.49) MAPK14ALDH1A1HPGDALOX5KDM4E
SCHEMBL6723556 0.87 MAPK14 (0.40) MAPK14MAPK13GCGRMAPK12MAPK11
SCHEMBL6733875 0.87 IDO1 (0.39) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL6733777 0.86 PTGS2 (0.36) MAPK14MAPK11ALDH1A1HPGDALOX5
SCHEMBL6731818 0.85 PTGS2 (0.38) MAPK14MAPK11ALDH1A1HPGDALOX5
SCHEMBL6728169 0.85 MAPK14 (0.44) MAPK14MAPK13MAPK12MAPK11ALDH1A1

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 MAPK14 2311/4885MAPK13 2331/4885GCGR 1295/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 MAPK14 2311/4885MAPK13 2331/4885GCGR 1295/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 MAPK14 2311/4885MAPK13 2331/4885GCGR 1295/4885

“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.