SCHEMBL6838993

SCHEMBL6838993

NS(=O)(=O)c1ccc(F)c(-c2ncccc2-c2ccc(OC(F)(F)F)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.48
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
ABL1 P00519 5/20 0.44
BCR P11274 2/20 0.44
PTGS1 P23219 6/20 0.43
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
SCD O00767 1/20 0.40
CCR9 P51686 1/20 0.39
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39

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
SCHEMBL6839195 0.89 CA1 (0.43) PTGS2CA1CA2ABL1BCR
SCHEMBL6839129 0.85 KIF11 (0.49) PTGS2CA1CA2PTGS1CA12
SCHEMBL6839726 0.85 PTGS2 (0.55) PTGS2CA1CA2PTGS1CA12
SCHEMBL6743053 0.85 PTGS2 (0.41) PTGS2CA1CA2ABL1BCR
SCHEMBL6836328 0.85 PTGS2 (0.47) PTGS2CA1CA2PTGS1FFAR1
SCHEMBL6837154 0.85 CA1 (0.41) PTGS2CA1CA2PTGS1
SCHEMBL6838913 0.84 PTGS2 (0.54) PTGS2CA1CA2PTGS1CA12
SCHEMBL6839563 0.84 PTGS2 (0.52) PTGS2CA1CA2PTGS1CA12
SCHEMBL6840873 0.83 CA2 (0.49) PTGS2CA1CA2PTGS1CA12
SCHEMBL6841826 0.83 PTGS2 (0.56) PTGS2CA1CA2PTGS1CA12

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 10/4885CA1 2085/4885CA2 3175/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885CA1 2085/4885CA2 3175/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885CA1 2085/4885CA2 3175/4885

“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.