SCHEMBL6725969

SCHEMBL6725969

NS(=O)(=O)c1ccc(-c2csc(=O)n2-c2cccc(OC(F)(F)F)c2)cc1F

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 3/20 0.38
PTGS2 P35354 2/20 0.38
PIM1 P11309 2/20 0.35
PIM2 Q9P1W9 2/20 0.35
TRPV1 Q8NER1 1/20 0.34
ENPP2 Q13822 1/20 0.34
SCN9A Q15858 1/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
ABL1 P00519 1/20 0.33
KAT6A Q92794 1/20 0.33
DYRK1A Q13627 2/20 0.33
CHRM5 P08912 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
PDE10A Q9Y233 1/20 0.32
DHODH Q02127 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
SCHEMBL6725490 0.90 PIM1 (0.35) PTGS2PIM1PIM2KAT6ADYRK1A
SCHEMBL6730037 0.90 PTGS2 (0.43) PTGS2TRPV1ENPP2CA1CA2
SCHEMBL6729851 0.88 PTGES2 (0.35) PTGES2PIM1PIM2CA1CA2
SCHEMBL6729466 0.86 PTGES2 (0.36) PTGES2PIM1PIM2TRPV1ENPP2
SCHEMBL6723252 0.86 PTGS2 (0.37) PTGES2PTGS2CA1CA2CA12
SCHEMBL6723659 0.85 PTGS2 (0.37) PTGS2CA1CA2CA12CA9
SCHEMBL6725791 0.84 PTGS2 (0.44) PTGES2PTGS2CA1CA2CA12
SCHEMBL6718730 0.83 PTGS2 (0.38) PTGS2
SCHEMBL6723063 0.83 PTGS2 (0.38) PTGS2SCN9A
SCHEMBL7111140 0.83 DYRK1A (0.35) PIM1PIM2DYRK1ACHRM5PDE10A

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 PTGES2 3/4885PTGS2 5/4885PIM1 2964/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGES2 2/4885PTGS2 5/4885PIM1 3179/4885

“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.