SCHEMBL6744670

SCHEMBL6744670

Cc1cc(-n2c(-c3ccc(S(N)(=O)=O)c(F)c3F)coc2=O)ccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.50
PTGS1 P23219 19/20 0.50

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
SCHEMBL6747495 0.90 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL6747465 0.90 PTGS2 (0.45) PTGS2PTGS1
SCHEMBL6739229 0.86 PTGS2 (0.49) PTGS2PTGS1
SCHEMBL6722986 0.84 PTGS2 (0.57) PTGS2PTGS1
SCHEMBL6728241 0.80 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL6739326 0.79 PTGS2 (0.43) PTGS2PTGS1
SCHEMBL6732162 0.78 PTGS2 (0.49) PTGS2PTGS1
SCHEMBL6726131 0.77 PTGS2 (0.50) PTGS2PTGS1
SCHEMBL6736233 0.76 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL6740178 0.76 PTGS2 (0.47) 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