SCHEMBL6747465

SCHEMBL6747465

Cc1ccc(-n2c(-c3ccc(S(N)(=O)=O)c(F)c3F)coc2=O)cc1C

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.45
PTGS1 P23219 17/20 0.45

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
SCHEMBL6744670 0.90 PTGS2 (0.50) PTGS2PTGS1
SCHEMBL6739193 0.85 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL6747495 0.84 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL6719211 0.83 PTGS2 (0.54) PTGS2PTGS1
SCHEMBL6740178 0.79 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL6732497 0.79 PTGS2 (0.49) PTGS2PTGS1
SCHEMBL6736608 0.78 PTGS2 (0.53) PTGS2PTGS1
SCHEMBL6740213 0.77 PTGS2 (0.45) PTGS2PTGS1
SCHEMBL6733553 0.77 PTGS2 (0.45) PTGS2PTGS1
SCHEMBL6729818 0.77 PTGS2 (0.45) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6699884-B2 ANTIINFLAMMATORY CYCLOOXYGENASE INHIBITORS. PHARMACIA CORPORATION 2004-03-02 US claimed