SCHEMBL6729995

SCHEMBL6729995

CS(=O)(=O)c1ccc(-c2c(-c3cccc(OC(F)(F)F)c3)noc2CO)cc1F

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.41
S1PR1 P21453 1/20 0.37
TRPV3 Q8NET8 1/20 0.37
DHFR P00374 1/20 0.36
DHODH Q02127 6/20 0.36
KCNK3 O14649 1/20 0.35
NR1H2 P55055 1/20 0.34
PTGS1 P23219 2/20 0.34
PDE3A Q14432 1/20 0.34
GRM5 P41594 1/20 0.34
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL6722921 0.92 PTGS2 (0.42) PTGS2S1PR1DHFRDHODHKCNK3
SCHEMBL6726246 0.91 PTGS2 (0.48) PTGS2S1PR1TRPV3DHFRDHODH
SCHEMBL6722266 0.91 PTGS2 (0.42) PTGS2NR1H2PTGS1PDE3A
SCHEMBL6728659 0.89 PTGS2 (0.41) PTGS2S1PR1TRPV3DHFRDHODH
SCHEMBL6731546 0.88 PTGS2 (0.37) PTGS2S1PR1TRPV3DHFRDHODH
SCHEMBL6721931 0.87 PTGS2 (0.44) PTGS2S1PR1DHODHPTGS1
SCHEMBL6718629 0.86 PTGS2 (0.51) PTGS2S1PR1DHFRDHODHNR1H2
SCHEMBL6722586 0.86 ELANE (0.44) PTGS2S1PR1NR1H2
SCHEMBL6730378 0.85 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL6723328 0.85 PTGS2 (0.37) PTGS2NR1H2FFAR1FFAR4

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 5/4885S1PR1 199/4885TRPV3 2086/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885S1PR1 199/4885TRPV3 1898/4885

“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.