SCHEMBL6726075

SCHEMBL6726075

Cc1csc(-c2noc(CO)c2-c2ccc(S(C)(=O)=O)c(F)c2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.38
PIK3CA P42336 3/20 0.38
PIK3CB P42338 3/20 0.38
PIK3CG P48736 3/20 0.38
PTGS2 P35354 4/20 0.37
BRD4 O60885 1/20 0.37
PPARA Q07869 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
TGFBR1 P36897 1/20 0.33
THRB P10828 1/20 0.32
GPR119 Q8TDV5 2/20 0.32
PTGS1 P23219 2/20 0.32
GABRA1 P14867 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 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
SCHEMBL6729542 0.91 PTGS2 (0.43) PTGS2BRD4PPARAALDH1A1PTGS1
SCHEMBL6725661 0.91 PTGS2 (0.38) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6733576 0.87 PTGS2 (0.34) PTGS2BRD4PPARATGFBR1
SCHEMBL6718593 0.87 PTGS2 (0.45) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6736383 0.85 NR1H2 (0.33) NR1H2NR1H3
SCHEMBL6722788 0.84 PIK3CD (0.38) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6730475 0.83 PIK3CD (0.37) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6721334 0.83 PTGS2 (0.47) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6718249 0.82 PTGS2 (0.43) PTGS2BRD4TGFBR1PTGS1LMNA
SCHEMBL6723697 0.82 PTGS2 (0.46) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2

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 PIK3CD 4290/4885PIK3CA 3770/4885PIK3CB 2965/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PIK3CD 4382/4885PIK3CA 3934/4885PIK3CB 3178/4885

“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.