SCHEMBL5336874

SCHEMBL5336874

CN(C1CCN(c2ccc(N3CC(Cn4ccnn4)OC3=O)cc2F)CC1)S(C)(=O)=O

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOA P21397 16/20 0.70
MAOB P27338 2/20 0.70
KCNH2 Q12809 1/20 0.63
CYP3A4 P08684 3/20 0.54
CYP2D6 P10635 1/20 0.54

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
SCHEMBL5232602 0.86 MAOA (0.71) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL5238909 0.85 MAOA (0.80) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL5320223 0.85 MAOA (0.80) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL5324047 0.84 MAOA (0.76) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL5228881 0.84 MAOA (0.76) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL4160608 0.84 MAOA (0.78) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL5234089 0.84 MAOA (0.68) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL5737970 0.83 MAOA (0.74) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL24169742 0.83 MAOA (1.00) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL18410322 0.83 MAOA (1.00) MAOAMAOBKCNH2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1286998-B2 OXAZOLIDINONE DERIVATIVES WITH ANTIBIOTIC ACTIVITY ASTRAZENECA AB (SE) 2007-10-31 EP disclosed
US-7141583-B2 Oxazolidinone derivatives with antibiotic activity ASTRAZENECA AB (SE) 2006-11-28 US disclosed
EP-1286998-B1 OXAZOLIDINONE DERIVATIVES WITH ANTIBIOTIC ACTIVITY ASTRAZENECA AB (SE) 2004-06-09 EP disclosed