SCHEMBL7254206

SCHEMBL7254206

Cc1cc(-c2ccc(S(C)(=O)=O)cc2)c(-c2ccc(Cl)cc2)c(=O)o1

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.64

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
SCHEMBL7254310 0.88 PTGS2 (0.52) PTGS2
SCHEMBL5708965 0.88 PTGS2 (0.65) PTGS2
SCHEMBL5709027 0.86 PTGS2 (0.64) PTGS2
SCHEMBL7254559 0.84 PTGS2 (0.71) PTGS2
SCHEMBL7254174 0.83 PTGS2 (0.51) PTGS2
SCHEMBL7259676 0.83 PTGS2 (0.51) PTGS2
SCHEMBL7259692 0.83 PTGS2 (0.67) PTGS2
SCHEMBL5708983 0.80 PTGS2 (0.67) PTGS2
SCHEMBL5709000 0.79 PTGS2 (0.59) PTGS2
SCHEMBL5708993 0.78 PTGS2 (1.00) PTGS2

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
WO-2003006451-A1 4-PHENYLPYRAN-2-ONE DERIVATIVES ALMIRALL PRODESFARMA S.A. (ES) 2003-01-23 WO disclosed