SCHEMBL8660237

SCHEMBL8660237

NS(=O)(=O)c1ccccc1-c1ccccc1-c1cc(F)c(Cl)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 7/20 0.50
FEN1 P39748 7/20 0.50
PTGS2 P35354 5/20 0.49
PTGS1 P23219 4/20 0.49
PTGES2 Q9H7Z7 3/20 0.42
F10 P00742 1/20 0.40
CA2 P00918 3/20 0.39
CA1 P00915 2/20 0.39
CA4 P22748 2/20 0.39
CA6 P23280 2/20 0.39
CA7 P43166 2/20 0.39
CA12 O43570 1/20 0.39
CYP2C9 P11712 1/20 0.39
CA5A P35218 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39

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
SCHEMBL8660206 0.91 ALOX5AP (0.48) ALOX5APFEN1PTGS2PTGS1PTGES2
SCHEMBL8659220 0.89 ALOX5AP (0.51) ALOX5APFEN1PTGS2PTGS1PTGES2
SCHEMBL8658337 0.86 PTGS2 (0.56) ALOX5APFEN1PTGS2PTGS1PTGES2
SCHEMBL8656801 0.86 ALOX5AP (0.49) ALOX5APFEN1PTGS2PTGS1F10
SCHEMBL8662888 0.86 PTGS2 (0.51) ALOX5APFEN1PTGS2PTGS1PTGES2
SCHEMBL8661067 0.85 PTGES2 (0.48) ALOX5APFEN1PTGS2PTGS1PTGES2
SCHEMBL8658525 0.84 ALOX5AP (0.57) ALOX5APFEN1PTGS2PTGS1F10
SCHEMBL8658017 0.83 PTGS1 (0.49) ALOX5APFEN1PTGS2PTGS1PTGES2
SCHEMBL8661644 0.83 PTGS1 (0.49) ALOX5APFEN1PTGS2PTGS1PTGES2
SCHEMBL8663422 0.83 PTGS2 (0.72) ALOX5APFEN1PTGS2PTGS1PTGES2

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