SCHEMBL6668615

SCHEMBL6668615

NC(=O)CCC1CN(c2ccc(-c3ccc(-c4c[nH]nn4)nc3)c(F)c2)C(=O)O1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 11/20 0.55
MAOB P27338 2/20 0.55
CALML3 P27482 6/20 0.50
CYP2C19 P33261 2/20 0.46
CYP2C9 P11712 1/20 0.46
CYP3A4 P08684 1/20 0.46

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
SCHEMBL6643893 0.86 MAOA (0.54) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL6644757 0.84 CALML3 (0.58) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL6672395 0.84 MAOA (0.53) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL6670687 0.84 MAOA (0.53) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL4577649 0.84 MAOA (0.53) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL6614776 0.84 CALML3 (0.57) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL6613014 0.84 CALML3 (0.59) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL6688141 0.83 MAOA (0.56) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL6610002 0.83 MAOA (0.53) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL6625771 0.83 MAOA (0.81) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1289984-A4 NOVEL OXAZOLIDINONE DERIVATIVES AND A PROCESS FOR THE PREPARATION THEREOF DONG A PHARM CO LTD (KR) 2004-11-24 EP disclosed
EP-1289984-A1 NOVEL OXAZOLIDINONE DERIVATIVES AND A PROCESS FOR THE PREPARATION THEREOF Dong A Pharmaceutical Co. Ltd. (KR) 2003-03-12 EP disclosed
WO-2001094342-A1 NOVEL OXAZOLIDINONE DERIVATIVES AND A PROCESS FOR THE PREPARATION THEREOF DONG A PHARM. CO., LTD. (KR) 2001-12-13 WO disclosed