SCHEMBL6723322

SCHEMBL6723322

COc1cc(-c2noc(C(F)(F)F)c2-c2ccc(S(N)(=O)=O)c(F)c2)ccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.43
PTGS1 P23219 7/20 0.42
CA4 P22748 1/20 0.42
PAX8 Q06710 1/20 0.39
RIPK2 O43353 1/20 0.37
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL6722734 0.92 PTGS2 (0.46) PTGS2PTGS1CA4
SCHEMBL6725669 0.91 PTGS2 (0.48) PTGS2PTGS1CA4PAX8RIPK2
SCHEMBL6735261 0.89 PTGS2 (0.43) PTGS2PTGS1CA4PAX8RIPK2
SCHEMBL6739473 0.89 PTGS2 (0.41) PTGS2PTGS1CA4PAX8RIPK2
SCHEMBL6722439 0.88 PTGS2 (0.46) PTGS2PTGS1CA4
SCHEMBL6730128 0.88 PTGS2 (0.45) PTGS2PTGS1CA4
SCHEMBL6722613 0.87 PAX8 (0.54) PTGS2PTGS1CA4PAX8MEN1
SCHEMBL6721870 0.85 PTGS2 (0.45) PTGS2PTGS1CA4
SCHEMBL6723146 0.85 PTGS2 (0.45) PTGS2PTGS1CA4PAX8RIPK2
SCHEMBL6718456 0.85 CA4 (0.44) PTGS2PTGS1CA4PAX8RIPK2

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 5/4885PTGS1 4/4885CA4 3185/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885PTGS1 4/4885CA4 3243/4885

“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.