SCHEMBL9595267

SCHEMBL9595267

CC(C)(C)c1cc(CC(CCOC(Cc2cc(-n3nc4ccc(S(=O)(=O)c5ccccc5)cc4n3)c(O)c(C(C)(C)C)c2)C(=O)O)C(=O)O)cc(-n2nc3ccc(S(=O)(=O)c4ccccc4)cc3n2)c1O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.31
ALOX5 P09917 1/20 0.31
PPARG P37231 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31

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
SCHEMBL8958870 0.85 PTGES (0.31) PTGESALOX5PPARG
SCHEMBL15163389 0.80 PPARG (0.37) PTGESALOX5PPARGMAOAMAOB
SCHEMBL5627436 0.78 MAOB (0.38) MAOAMAOB
SCHEMBL30772441 0.78 FOLH1 (0.39) PTGESALOX5PPARGMAOAMAOB
SCHEMBL672758 0.78 FOLH1 (0.39) PTGESALOX5PPARGMAOAMAOB
SCHEMBL8050308 0.77 PTGS2 (0.33)
SCHEMBL4822523 0.77 MAOB (0.40) MAOAMAOB
SCHEMBL5834851 0.77 MAOB (0.37) MAOAMAOB
SCHEMBL7787071 0.77 MAOB (0.37) MAOAMAOB
SCHEMBL5834070 0.77 CNR2 (0.35) MAOAMAOB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0572554-A1 5-SULFONYL-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS Ciba SC Holding AG (CH) 1993-12-08 EP disclosed
WO-1992014717-A1 5-SULFONYL-SUBSTITUTED BENZOTRIAZOLE UV-ABSORBERS AND STABILIZED COMPOSITIONS CIBA-GEIGY AG (CH) 1992-09-03 WO disclosed