SCHEMBL6733630

SCHEMBL6733630

CS(=O)(=O)c1ccc(-c2cscc2-c2ccc(C(F)(F)F)cc2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.51
ALOX5AP P20292 3/20 0.48
FEN1 P39748 3/20 0.48
PTGS1 P23219 2/20 0.44
APP P05067 1/20 0.43
KIF11 P52732 5/20 0.41
POLB P06746 1/20 0.40
ABCB11 O95342 1/20 0.40

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
SCHEMBL6721924 0.88 ALOX5AP (0.46) PTGS2ALOX5APFEN1PTGS1KIF11
SCHEMBL6723235 0.86 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL6735699 0.85 PTGS2 (0.49) PTGS2ALOX5APFEN1PTGS1APP
SCHEMBL6722447 0.85 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL6729849 0.85 PTGS2 (0.54) PTGS2PTGS1
SCHEMBL6723701 0.85 PTGS2 (0.60) PTGS2ALOX5APFEN1PTGS1
SCHEMBL6718619 0.84 PTGS2 (0.53) PTGS2PTGS1
SCHEMBL6718691 0.83 PTGS2 (0.53) PTGS2PTGS1
SCHEMBL6723198 0.83 PTGS2 (0.45) PTGS2ALOX5APFEN1PTGS1KIF11
SCHEMBL6729970 0.83 PTGS2 (0.51) PTGS2ALOX5APFEN1PTGS1KIF11

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 6 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
US-20030232996-A1 Regioselective synthesis of 3,4-di{(carboclyl or heterocyclyl)thiophenes PHARMACIA CORPORATION 2003-12-18 US disclosed
US-6600052-B1 With a ring cyclizing reagent to form the compound of Formula V to yield a compound of Formula V: inhibitors of the cyclooxygenase- II enzyme. and antiinflammatory agents and analgesic pharmaceutical agents. PHARMACIA CORPORATION 2003-07-29 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 (3 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 5/4885ALOX5AP 454/4885FEN1 1649/4885
US-20030232996-A1 Regioselective synthesis of 3,4-di{(carboclyl or heterocyclyl)thiophenes CCNE2, CCNC, CYP3A4 PTGS2 784/4885ALOX5AP 3335/4885FEN1 2008/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885ALOX5AP 395/4885FEN1 1713/4885

“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.