SCHEMBL6300839

SCHEMBL6300839

CS(=O)(=O)c1ccc(-c2coc(=O)n2-c2cccc(Cl)c2)cc1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.78
PTGS1 P23219 19/20 0.78

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
SCHEMBL6307729 0.88 PTGS2 (0.80) PTGS2PTGS1
SCHEMBL8724654 0.88 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL8397591 0.86 PTGS2 (0.73) PTGS2PTGS1
SCHEMBL8721601 0.86 PTGS2 (0.73) PTGS2PTGS1
SCHEMBL4575742 0.86 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL8397305 0.85 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6308147 0.85 PTGS2 (0.78) PTGS2PTGS1
SCHEMBL8720980 0.84 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL8726248 0.83 PTGS2 (0.72) PTGS2PTGS1
SCHEMBL6718915 0.82 PTGS2 (0.60) PTGS2PTGS1

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
US-6869968-B1 Such as 3-(4-fluorophenyl)-4-(4-methysulphonylphenyl)-2-(3H)-oxazolone; for treating colorectal cancer, fevers, and inflammation ALLMIRALL PRODESFARMA S.A. (ES) 2005-03-22 US claimed
US-5866596-A DRUGS WITH ANTIINFLAMMATORY AND ANALGESIC PROPERTIES. LABORATORIES UPSA (FR) 1999-02-02 US claimed
US-5866596-A DRUGS WITH ANTIINFLAMMATORY AND ANALGESIC PROPERTIES. LABORATORIES UPSA (FR) 1999-02-02 US disclosed