SCHEMBL8660106

SCHEMBL8660106

NS(=O)(=O)c1ccccc1-c1c(F)c(F)c(F)c(F)c1-c1ccc(F)c(Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 14/20 0.58
PTGS1 P23219 10/20 0.58
ALOX5AP P20292 4/20 0.44
FEN1 P39748 4/20 0.44
PTGES2 Q9H7Z7 1/20 0.43
F10 P00742 1/20 0.43

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
SCHEMBL8657428 0.91 PTGES2 (0.53) PTGS2PTGS1ALOX5APFEN1PTGES2
SCHEMBL8658241 0.90 ALOX5AP (0.46) PTGS2PTGS1ALOX5APFEN1PTGES2
SCHEMBL8661401 0.88 ALOX5AP (0.49) PTGS2PTGS1ALOX5APFEN1F10
SCHEMBL8661367 0.88 PTGS2 (0.45) PTGS2PTGS1ALOX5APFEN1PTGES2
SCHEMBL8659234 0.87 PTGS2 (0.54) PTGS2PTGS1ALOX5APFEN1PTGES2
SCHEMBL8657561 0.86 PTGS1 (0.43) PTGS2PTGS1ALOX5APFEN1PTGES2
SCHEMBL8662873 0.86 PTGS2 (0.50) PTGS2PTGS1ALOX5APFEN1PTGES2
SCHEMBL8656122 0.85 F10 (0.41) PTGS2PTGS1ALOX5APFEN1PTGES2
SCHEMBL8658257 0.85 PTGS1 (0.41) PTGS2PTGS1ALOX5APFEN1PTGES2
SCHEMBL8661455 0.85 ALOX5AP (0.46) PTGS2PTGS1ALOX5APFEN1PTGES2

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-5739166-A ALKYLSULFONYL OR AMINOSULFONYL SUBSTITUTED AROMATIC COMPOUNDS AS NON-STEROIDAL ANTIINFLAMMATORY AGENT G.D. SEARLE & CO. (US) 1998-04-14 US disclosed