SCHEMBL9302049

SCHEMBL9302049

CCOCCOCCOCCOCCOCCOCCOCCC(OC(=O)CCc1cc(-n2nc3ccc(Sc4ccccc4)cc3n2)c(O)c(C(C)(C)C)c1)OC(=O)CCc1cc(-n2nc3ccc(Sc4ccccc4)cc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.32
MAOA P21397 2/20 0.32
ACHE P22303 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL8384833 0.84 MAOB (0.31) MAOBMAOA
SCHEMBL8050940 0.82 MAOB (0.39) MAOBMAOAACHEGAA
SCHEMBL8379884 0.81 CNR2 (0.37) MAOBMAOA
SCHEMBL9320497 0.80 MAOB (0.34) MAOBMAOAACHEGAA
SCHEMBL8050552 0.80 MAOB (0.38) MAOBMAOAACHEGAA
SCHEMBL8050554 0.80 MAOB (0.38) MAOBMAOAACHEGAA
SCHEMBL9318475 0.80 MAOB (0.35) MAOBMAOAACHEGAA
SCHEMBL8382964 0.80 MAOB (0.33) MAOBMAOAACHEGAA
SCHEMBL8050174 0.78 MAOA (0.30) MAOBMAOA
SCHEMBL8040272 0.77 MAOB (0.32) MAOBMAOAACHEGAA

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-5278314-A N-Phenol-substituted benzotriazoles CIBA-GEIGY CORPORATION (US) 1994-01-11 US disclosed