SCHEMBL6740304

SCHEMBL6740304

CS(=O)(=O)c1cc(F)c(-c2nc(C(F)F)[nH]c2-c2ccc(Br)c(Br)c2)cc1F

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
PTGS2 P35354 3/20 0.32
PTGS1 P23219 2/20 0.32
CYP3A4 P08684 2/20 0.30
MAPK14 Q16539 2/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30
TYK2 P29597 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 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
SCHEMBL6737558 0.92 PTGS2 (0.33) ALOX5PTGS2PTGS1TYK2KDM4E
SCHEMBL6738743 0.92 PTGS2 (0.33) ALOX5PTGS2PTGS1TYK2KDM4E
SCHEMBL6728986 0.89 ALOX5 (0.36) ALOX5PTGS2PTGS1CYP3A4MAPK14
SCHEMBL6732359 0.88 ALOX5 (0.35) ALOX5PTGS2PTGS1MAPK14ALOX5AP
SCHEMBL6723368 0.87 PTGS1 (0.35) ALOX5PTGS2PTGS1CYP3A4MAPK14
SCHEMBL6739670 0.87 TYK2 (0.33) ALOX5PTGS2PTGS1TYK2ALDH1A1
SCHEMBL6731912 0.87 ALOX5 (0.44) ALOX5PTGS2PTGS1CYP3A4MAPK14
SCHEMBL6734086 0.87 MAPK13 (0.35) ALOX5PTGS2MAPK14TYK2KDM4E
SCHEMBL6740179 0.86 PTGS2 (0.34) ALOX5PTGS2PTGS1ALOX5APFEN1
SCHEMBL6735745 0.86 PTGS2 (0.42) ALOX5PTGS2PTGS1ALOX5APFEN1

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 ALOX5 165/4885PTGS2 10/4885PTGS1 4/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 ALOX5 165/4885PTGS2 10/4885PTGS1 4/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 ALOX5 165/4885PTGS2 10/4885PTGS1 4/4885

“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.