SCHEMBL6730037

SCHEMBL6730037

NS(=O)(=O)c1ccc(-c2csc(=O)n2-c2ccc(OC(F)(F)F)cc2)cc1F

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.43
ENPP2 Q13822 1/20 0.39
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTGS1 P23219 3/20 0.35
ACLY P53396 3/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
KIF11 P52732 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
LIPE Q05469 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
SCHEMBL6725969 0.90 PTGES2 (0.38) PTGS2ENPP2CA1CA2CA12
SCHEMBL6723682 0.90 PTGS2 (0.37) PTGS2POLBL3MBTL1PTGS1ACLY
SCHEMBL6735272 0.87 POLB (0.36) PTGS2POLBL3MBTL1PTGS1CA1
SCHEMBL6722822 0.86 PTGS2 (0.44) PTGS2PTGS1KIF11
SCHEMBL7111065 0.86 PTGS2 (0.42) PTGS2PTGS1CA1CA2CA12
SCHEMBL6732352 0.85 PTGS2 (0.35) PTGS2ENPP2POLBL3MBTL1ACLY
SCHEMBL6723063 0.85 PTGS2 (0.38) PTGS2PTGS1
SCHEMBL6718730 0.85 PTGS2 (0.38) PTGS2PTGS1
SCHEMBL6719412 0.85 CA2 (0.43) PTGS2PTGS1CA1CA2CA12
SCHEMBL6726544 0.84 PTGS2 (0.42) PTGS2PTGS1CA1CA2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-05-13 US disclosed
US-20020183362-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2002-12-05 US 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-20020183362-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, FPR1, PTGES2 PTGS2 5/4885ENPP2 228/4885POLB 3233/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885ENPP2 257/4885POLB 3122/4885

“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.