SCHEMBL6897638

SCHEMBL6897638

Cc1ccc(-c2cccnc2-c2cc(F)cc(S(N)(=O)=O)c2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 17/20 0.53
PTGS1 P23219 13/20 0.53
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
KMO O15229 1/20 0.37

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
SCHEMBL6837050 0.91 PTGS2 (0.53) PTGS2PTGS1CA1CA2KMO
SCHEMBL6838365 0.90 PTGS2 (0.50) PTGS2PTGS1CA1CA2
SCHEMBL6836086 0.90 PTGS1 (0.46) PTGS2PTGS1CA1CA2KMO
SCHEMBL6839423 0.90 PTGS2 (0.44) PTGS2PTGS1CA1CA2
SCHEMBL6837498 0.88 PTGS2 (0.40) PTGS2PTGS1CA1CA2
SCHEMBL6834606 0.87 PTGS2 (0.52) PTGS2PTGS1CA1CA2
SCHEMBL6835134 0.86 PTGS2 (0.57) PTGS2PTGS1
SCHEMBL6835088 0.86 PTGS2 (0.40) PTGS2PTGS1CA1CA2
SCHEMBL6833679 0.85 PTGS2 (0.49) PTGS2PTGS1CA1CA2
SCHEMBL6840518 0.85 CA1 (0.44) PTGS2PTGS1CA1CA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (2 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-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885PTGS1 4/4885CA1 2085/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 PTGS2 10/4885PTGS1 4/4885CA1 2085/4885

“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.