SCHEMBL4709151

SCHEMBL4709151

CC1CN(c2ccc(-c3ccc(N4CCS(=O)(=O)CC4)nc3)c(F)c2)C(=O)O1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 12/20 0.50
MAOB P27338 2/20 0.50
CALML3 P27482 6/20 0.49
CYP2C19 P33261 2/20 0.47
CYP2C9 P11712 1/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL4171622 0.89 CALML3 (0.64) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL4171626 0.89 CALML3 (0.64) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL4709149 0.89 CALML3 (0.49) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL6673481 0.86 CALML3 (0.51) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL4708465 0.85 CALML3 (0.50) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL6625009 0.85 MAOA (0.49) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL4173660 0.85 MAOA (0.63) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL13945058 0.85 MAOA (0.51) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL4173652 0.85 MAOA (0.63) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL4177230 0.84 CALML3 (0.51) MAOAMAOBCALML3CYP2C19CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1912980-A2 OXAZOLIDINONES BEARING ANTIMICROBIAL ACTIVITY COMPOSITION AND METHODS OF PREPARATION Wockhardt Limited (IN) 2008-04-23 EP claimed
WO-2007023507-A2 OXAZOLIDINONES BEARING ANTIMICROBIAL ACTIVITY COMPOSITION AND METHODS OF PREPARATION WOCKHARDT LIMITED (IN) 2007-03-01 WO claimed
EP-1912980-A2 OXAZOLIDINONES BEARING ANTIMICROBIAL ACTIVITY COMPOSITION AND METHODS OF PREPARATION Wockhardt Limited (IN) 2008-04-23 EP disclosed
WO-2007023507-A2 OXAZOLIDINONES BEARING ANTIMICROBIAL ACTIVITY COMPOSITION AND METHODS OF PREPARATION WOCKHARDT LIMITED (IN) 2007-03-01 WO disclosed