SCHEMBL6723252

SCHEMBL6723252

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.37
GAA P10253 1/20 0.37
ALOX5AP P20292 2/20 0.36
FEN1 P39748 2/20 0.36
CYP1A2 P05177 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
PTGES2 Q9H7Z7 3/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
TSHR P16473 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PLA2G10 O15496 1/20 0.34
RGS4 P49798 1/20 0.34

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
SCHEMBL6723420 0.90 ELANE (0.38) GAAALOX5APFEN1CYP1A2TP53
SCHEMBL6722822 0.88 PTGS2 (0.44) PTGS2ALOX5APFEN1
SCHEMBL6729121 0.87 GAA (0.38) GAACYP1A2TP53MAPTPTGES2
SCHEMBL6723659 0.87 PTGS2 (0.37) PTGS2CA12CA1CA2CA9
SCHEMBL6725791 0.86 PTGS2 (0.44) PTGS2MAPTPTGES2CA12CA1
SCHEMBL6725969 0.86 PTGES2 (0.38) PTGS2PTGES2CA12CA1CA2
SCHEMBL6732364 0.85 GAA (0.37) GAAALOX5APFEN1CYP1A2TP53
SCHEMBL6718932 0.85 CA12 (0.40) PTGS2CA12CA1CA2CA9
SCHEMBL6730267 0.83 CA12 (0.37) PTGS2PTGES2CA12CA1CA2
SCHEMBL6722693 0.82 CA1 (0.39) PTGS2CA1CA2

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 5/4885GAA 3901/4885ALOX5AP 454/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885GAA 3834/4885ALOX5AP 395/4885

“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.