SCHEMBL7044133

SCHEMBL7044133

Cc1cc(-c2cccnc2-c2ccc(S(C)(=O)=O)c(F)c2)ccc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 5/20 0.44
NR1H3 Q13133 5/20 0.44
PTGS2 P35354 4/20 0.42
PTGS1 P23219 3/20 0.42
KIF11 P52732 1/20 0.41
ALOX5AP P20292 6/20 0.39
FEN1 P39748 6/20 0.39
KMO O15229 1/20 0.39
SCN5A Q14524 1/20 0.39
SCN9A Q15858 1/20 0.39
TRPV1 Q8NER1 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37

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
SCHEMBL7045240 0.91 NR1H2 (0.44) NR1H2NR1H3PTGS2PTGS1KIF11
SCHEMBL6730163 0.90 PTGS1 (0.40) NR1H2NR1H3PTGS2PTGS1KIF11
SCHEMBL7537379 0.88 PTGS2 (0.47) PTGS2PTGS1ALOX5APFEN1KMO
SCHEMBL7041595 0.88 PTGS2 (0.47) NR1H2NR1H3PTGS2PTGS1ALOX5AP
SCHEMBL7048786 0.86 PTGS2 (0.47) PTGS2PTGS1ALOX5APFEN1KMO
SCHEMBL7048301 0.84 PTGS2 (0.50) PTGS2PTGS1ALOX5APFEN1KMO
SCHEMBL7046371 0.84 PTGS2 (0.43) PTGS2PTGS1ALOX5APFEN1KMO
SCHEMBL7044152 0.84 PTGS2 (0.40) NR1H2NR1H3PTGS2PTGS1ALOX5AP
SCHEMBL7540499 0.84 PTGS2 (0.48) NR1H2NR1H3PTGS2PTGS1ALOX5AP
SCHEMBL7546410 0.84 PTGS2 (0.49) NR1H2NR1H3PTGS2PTGS1ALOX5AP

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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 NR1H2 282/4885NR1H3 570/4885PTGS2 5/4885

“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.