SCHEMBL6725399

SCHEMBL6725399

Cc1cc(-c2noc(C(F)F)c2-c2ccc(S(C)(=O)=O)c(F)c2)ccc1OC(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 6/20 0.37
PTGS2 P35354 5/20 0.34
NR1H2 P55055 3/20 0.33
NR1H3 Q13133 2/20 0.33
SCN5A Q14524 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
PAX8 Q06710 1/20 0.32
S1PR1 P21453 1/20 0.32
EPAS1 Q99814 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
SCHEMBL6718551 0.93 PAX8 (0.34) GRM2PTGS2NR1H2NR1H3GPR119
SCHEMBL6723487 0.92 CA4 (0.39) GRM2PTGS2SCN5APAX8
SCHEMBL6740496 0.90 GRM2 (0.36) GRM2PTGS2SCN5AS1PR1
SCHEMBL6723342 0.88 PTGS2 (0.45) GRM2PTGS2NR1H2SCN5APAX8
SCHEMBL6722681 0.87 PTGS2 (0.48) GRM2PTGS2NR1H2NR1H3SCN5A
SCHEMBL6719238 0.86 PTGS2 (0.38) PTGS2NR1H2GPR119
SCHEMBL6723645 0.86 PTGS2 (0.40) PTGS2
SCHEMBL6726081 0.86 PTGS2 (0.40) PTGS2PAX8
SCHEMBL6726032 0.85 NR1H2 (0.38) GRM2PTGS2NR1H2NR1H3GPR119
SCHEMBL6725755 0.85 PTGS2 (0.39) GRM2PTGS2NR1H2NR1H3SCN5A

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 GRM2 893/4885PTGS2 5/4885NR1H2 282/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 GRM2 814/4885PTGS2 5/4885NR1H2 242/4885

“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.