SCHEMBL6732458

SCHEMBL6732458

CS(=O)(=O)c1ccc(-c2csc(=O)n2-c2cc(Br)cc(Br)c2)cc1F

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
PTGS2 P35354 6/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
PTGS1 P23219 3/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
FPR1 P21462 1/20 0.31
FPR2 P25090 1/20 0.31

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
SCHEMBL6721583 0.92 PTGS2 (0.38) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6729591 0.90 GSK3A (0.40) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6720119 0.88 PTGS2 (0.38) PTGS2CA12CA1CA2CA9
SCHEMBL6719075 0.88 PIK3CD (0.35) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6723555 0.87 PIK3CD (0.37) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6722067 0.87 CCR2 (0.36) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6725642 0.86 PTGS2 (0.36) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6726157 0.86 PTGS2 (0.39) PIK3CDPIK3CAPIK3CBPIK3CGPTGS2
SCHEMBL6722645 0.86 PTGS2 (0.42) PTGS2PTGS1
SCHEMBL6726139 0.85 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.