SCHEMBL6729016

SCHEMBL6729016

Cc1ccc(-c2noc(CO)c2-c2ccc(S(C)(=O)=O)c(F)c2)cc1Br

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.43
BRD4 O60885 4/20 0.42
PIK3CD O00329 2/20 0.35
PIK3CA P42336 2/20 0.35
PIK3CB P42338 2/20 0.35
PIK3CG P48736 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA7 P43166 1/20 0.35
BRD2 P25440 2/20 0.34
BRD3 Q15059 2/20 0.34
ALDH1A1 P00352 1/20 0.34
PTGS1 P23219 1/20 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
SCHEMBL6725773 0.92 PTGS2 (0.47) PTGS2BRD4CA1CA2CA4
SCHEMBL6733165 0.92 PTGS2 (0.43) PTGS2BRD4PIK3CDPIK3CAPIK3CB
SCHEMBL6722859 0.92 PTGS2 (0.44) PTGS2BRD4PIK3CDPIK3CAPIK3CB
SCHEMBL6729415 0.92 BRD4 (0.44) PTGS2BRD4PIK3CDPIK3CAPIK3CB
SCHEMBL6729446 0.91 PTGS2 (0.43) PTGS2BRD4PIK3CDPIK3CAPIK3CB
SCHEMBL6723362 0.91 BRD4 (0.44) PTGS2BRD4PIK3CDPIK3CAPIK3CB
SCHEMBL6736641 0.89 PTGS2 (0.43) PTGS2BRD4CA1CA2CA4
SCHEMBL6729994 0.89 PTGS2 (0.42) PTGS2BRD4PIK3CDPIK3CAPIK3CB
SCHEMBL6723093 0.88 PTGS2 (0.46) PTGS2BRD4PIK3CDPIK3CAPIK3CB
SCHEMBL6840085 0.88 PTGS2 (0.39) PTGS2BRD4CA1CA2CA4

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 5/4885BRD4 384/4885PIK3CD 4290/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885BRD4 340/4885PIK3CD 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.