SCHEMBL6725857

SCHEMBL6725857

NS(=O)(=O)c1ccc(-c2c(-c3cccc(C(F)(F)F)c3)noc2CO)cc1F

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.51
BRD4 O60885 1/20 0.39
F10 P00742 3/20 0.39
F2 P00734 2/20 0.39
S1PR1 P21453 1/20 0.38
PTGES2 Q9H7Z7 1/20 0.37
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MCOLN3 Q8TDD5 1/20 0.36
PTGS1 P23219 1/20 0.36
ELANE P08246 1/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
MAOB P27338 1/20 0.34
CNR2 P34972 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
SCHEMBL6725748 0.91 PTGS2 (0.52) PTGS2BRD4F10F2PTGES2
SCHEMBL6722586 0.90 ELANE (0.44) PTGS2BRD4S1PR1ALOX5APFEN1
SCHEMBL6718994 0.90 PTGS2 (0.52) PTGS2BRD4ALOX5APFEN1PTGS1
SCHEMBL6728926 0.88 PTGS2 (0.50) PTGS2BRD4F10F2S1PR1
SCHEMBL6718649 0.88 PTGS2 (0.55) PTGS2BRD4F10F2PTGS1
SCHEMBL6739848 0.87 PTGS2 (0.45) PTGS2BRD4F10F2S1PR1
SCHEMBL6720111 0.87 PTGS2 (0.67) PTGS2F10F2PTGS1
SCHEMBL6722694 0.86 PTGS2 (0.53) PTGS2BRD4F10F2PTGS1
SCHEMBL6722911 0.86 PTGS2 (0.53) PTGS2BRD4F10F2PTGS1
SCHEMBL6718472 0.86 PTGS2 (0.53) PTGS2BRD4F10F2PTGS1

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 5/4885BRD4 384/4885F10 1715/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885BRD4 340/4885F10 1908/4885

“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.