SCHEMBL6728950

SCHEMBL6728950

CS(=O)(=O)c1c(F)cc(C2=C(c3ccc(OC(F)(F)F)cc3)C=CC2)cc1F

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.43
KIF11 P52732 2/20 0.40
PTGS1 P23219 1/20 0.36
ABL1 P00519 2/20 0.33
BCR P11274 2/20 0.33
DHODH Q02127 1/20 0.33
CNR1 P21554 1/20 0.33
FFAR4 Q5NUL3 2/20 0.33
SCN9A Q15858 2/20 0.32
SCN5A Q14524 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
KCNH2 Q12809 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
SCHEMBL6733064 0.89 DHODH (0.37) PTGS2DHODHSCN9A
SCHEMBL6736461 0.84 PTGS2 (0.31) PTGS2KIF11
SCHEMBL6733066 0.84 PTGS2 (0.36) PTGS2KIF11PTGS1FFAR4SCN5A
SCHEMBL6735213 0.84 PTGS2 (0.42) PTGS2KIF11PTGS1
SCHEMBL6735444 0.84 PTGS2 (0.40) PTGS2PTGS1
SCHEMBL6732637 0.83 PTGS2 (0.35) PTGS2KIF11PTGS1
SCHEMBL6729355 0.83 PTGS2 (0.41) PTGS2KIF11PTGS1
SCHEMBL6734381 0.82 PTGS2 (0.38) PTGS2PTGS1
SCHEMBL6737041 0.81 PTGS2 (0.34) PTGS2PTGS1
SCHEMBL6735615 0.81 PTGS2 (0.45) PTGS2PTGS1

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 5 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 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 10/4885KIF11 4765/4885PTGS1 4/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885KIF11 4765/4885PTGS1 4/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885KIF11 4765/4885PTGS1 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.