SCHEMBL6723366

SCHEMBL6723366

Cc1ccc(-c2noc(CF)c2-c2ccc(S(C)(=O)=O)c(F)c2)cc1C#N

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.40
PIK3CD O00329 3/20 0.33
PIK3CA P42336 3/20 0.33
PIK3CB P42338 3/20 0.33
PIK3CG P48736 3/20 0.33
CTSC P53634 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
CA7 P43166 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SCN9A Q15858 1/20 0.32
BRD4 O60885 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL6722426 0.92 PTGS2 (0.40) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6722758 0.91 BRD4 (0.41) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6723862 0.91 PTGS2 (0.46) PTGS2CA1CA2CA4CA7
SCHEMBL6722942 0.90 PTGS2 (0.44) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6733198 0.89 PTGS2 (0.40) PTGS2CA1CA2CA4CA7
SCHEMBL6723142 0.89 PTGS2 (0.43) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6739271 0.88 PTGS2 (0.36) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL6722912 0.88 PTGS2 (0.47) PTGS2CA1CA2CA4CA7
SCHEMBL6722861 0.87 PTGS2 (0.44) PTGS2ALDH1A1
SCHEMBL6722854 0.86 PTGS2 (0.43) PTGS2PIK3CDPIK3CAPIK3CBPIK3CG

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 4 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
US-20020183362-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2002-12-05 US 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 (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 5/4885PIK3CD 4290/4885PIK3CA 3770/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885PIK3CD 4382/4885PIK3CA 3934/4885

“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.