SCHEMBL6729428

SCHEMBL6729428

Cc1ccc(-c2cccnc2-c2ccc(S(N)(=O)=O)c(F)c2)cc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 10/20 0.41
ALOX5AP P20292 9/20 0.41
PTGS1 P23219 2/20 0.40
PTGS2 P35354 2/20 0.40
LRRK2 Q5S007 1/20 0.39
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38
KIF11 P52732 1/20 0.38
NR1H2 P55055 3/20 0.37
NR1H3 Q13133 3/20 0.37
TRPV1 Q8NER1 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
SCHEMBL6730163 0.92 PTGS1 (0.40) FEN1ALOX5APPTGS1PTGS2LRRK2
SCHEMBL7045240 0.90 NR1H2 (0.44) FEN1ALOX5APPTGS1PTGS2SCN5A
SCHEMBL6725390 0.89 PTGS2 (0.45) FEN1ALOX5APPTGS1PTGS2
SCHEMBL6745117 0.88 ALOX5AP (0.40) FEN1ALOX5APPTGS1PTGS2LRRK2
SCHEMBL6746250 0.88 FEN1 (0.39) FEN1ALOX5APPTGS1PTGS2LRRK2
SCHEMBL6729554 0.88 PTGS2 (0.48) FEN1ALOX5APPTGS1PTGS2
SCHEMBL6723355 0.86 PTGS2 (0.42) FEN1ALOX5APPTGS1PTGS2
SCHEMBL6725930 0.85 PTGS2 (0.48) FEN1ALOX5APPTGS1PTGS2
SCHEMBL7048299 0.85 PTGS2 (0.51) FEN1ALOX5APPTGS1PTGS2
SCHEMBL6723491 0.85 PTGS1 (0.39) FEN1ALOX5APPTGS1PTGS2SCN9A

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 FEN1 1649/4885ALOX5AP 454/4885PTGS1 4/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 FEN1 1713/4885ALOX5AP 395/4885PTGS1 4/4885

“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.