SCHEMBL6740414

SCHEMBL6740414

Cc1cc(-c2noc(CO)c2-c2cc(F)c(S(C)(=O)=O)c(F)c2)ccc1C#N

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 6/20 0.40
BRD4 O60885 1/20 0.35
CYP11B1 P15538 4/20 0.35
CYP11B2 P19099 4/20 0.35
S1PR1 P21453 1/20 0.34
MAPK14 Q16539 1/20 0.34
NSD2 O96028 1/20 0.33
PTGS1 P23219 1/20 0.32
PDE3A Q14432 1/20 0.32
KDM1A O60341 1/20 0.32
EPAS1 Q99814 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
SCHEMBL6731699 0.92 PTGS2 (0.40) PTGS2BRD4CYP11B1CYP11B2MAPK14
SCHEMBL6741306 0.91 PTGS2 (0.46) PTGS2BRD4CYP11B1CYP11B2S1PR1
SCHEMBL6739526 0.91 PTGS2 (0.40) PTGS2CYP11B1CYP11B2S1PR1MAPK14
SCHEMBL6732167 0.89 PTGS2 (0.39) PTGS2BRD4CYP11B1CYP11B2S1PR1
SCHEMBL6728235 0.89 PTGS2 (0.43) PTGS2BRD4MAPK14PTGS1PDE3A
SCHEMBL6737367 0.89 PTGS2 (0.43) PTGS2BRD4MAPK14PTGS1PDE3A
SCHEMBL6735266 0.87 PTGS2 (0.44) PTGS2BRD4MAPK14PTGS1PDE3A
SCHEMBL6735965 0.87 PTGS2 (0.44) PTGS2PTGS1PDE3A
SCHEMBL6728527 0.87 PTGS2 (0.45) PTGS2BRD4MAPK14PTGS1PDE3A
SCHEMBL6735810 0.86 PTGS2 (0.48) PTGS2CYP11B1CYP11B2S1PR1PTGS1

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 10 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-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 10/4885BRD4 169/4885CYP11B1 583/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885BRD4 169/4885CYP11B1 583/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885BRD4 169/4885CYP11B1 583/4885

“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.