SCHEMBL6729336

SCHEMBL6729336

Cc1cc(-n2c(-c3ccc(S(C)(=O)=O)c(F)c3)csc2=O)ccc1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.39
PTGS2 P35354 9/20 0.35
PIK3CD O00329 2/20 0.35
PIK3CA P42336 2/20 0.35
PIK3CB P42338 2/20 0.35
PIK3CG P48736 2/20 0.35
PTGS1 P23219 2/20 0.33
NR1H2 P55055 2/20 0.33
NR1H3 Q13133 2/20 0.33

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
SCHEMBL6722657 0.92 PTGS2 (0.37) KIF11PTGS2PIK3CDPIK3CAPIK3CB
SCHEMBL6720055 0.91 PTGS2 (0.40) KIF11PTGS2PTGS1
SCHEMBL6721871 0.88 PTGS2 (0.40) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6730269 0.88 PIK3CD (0.38) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6725990 0.86 PTGS2 (0.40) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6734334 0.86 NR1H2 (0.36) KIF11PTGS2PIK3CDPIK3CAPIK3CB
SCHEMBL6726121 0.85 PTGS2 (0.40) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6718571 0.85 PTGS2 (0.37) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6729465 0.85 PTGS2 (0.35) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6718868 0.85 PTGS2 (0.44) PTGS2PTGS1

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 3 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
EP-1296971-A2 2-FLUOROBENZENESULFONYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION Pharmacia Corporation (US) 2003-04-02 EP disclosed
WO-2001081332-A2 2-FLUOROBENZENESULFONYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2001-11-01 WO 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 (1 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-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 KIF11 4773/4885PTGS2 5/4885PIK3CD 4382/4885

“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.