SCHEMBL6694501

SCHEMBL6694501

CCC(=O)NC1CN(c2ccc(-c3ccc(N4CCN(C(C)=O)CC4)nc3)c(F)c2)C(=O)O1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 11/20 0.48
MAOB P27338 4/20 0.48
CALML3 P27482 4/20 0.45
CYP2C19 P33261 2/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.44
WNT3A P56704 1/20 0.43

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
SCHEMBL6673605 0.92 MAOA (0.44) MAOAMAOBCALML3CYP2C19CYP3A4
SCHEMBL6672138 0.92 CALML3 (0.46) MAOAMAOBCALML3CYP2C19CYP3A4
SCHEMBL6670663 0.92 CYP2C19 (0.45) MAOAMAOBCALML3CYP2C19CYP3A4
SCHEMBL6624481 0.90 CALML3 (0.47) MAOAMAOBCALML3CYP2C19CYP3A4
SCHEMBL6669476 0.90 MAOA (0.44) MAOAMAOBCALML3CYP2C19CYP3A4
SCHEMBL6665916 0.90 MAOA (0.47) MAOAMAOBCALML3CYP2C19CYP3A4
SCHEMBL6671966 0.89 MAOA (0.47) MAOAMAOBCALML3CYP2C19CYP3A4
SCHEMBL6643604 0.89 CYP2C19 (0.45) MAOAMAOBCALML3CYP2C19CYP3A4
SCHEMBL6667976 0.89 CALML3 (0.44) MAOAMAOBCALML3CYP2C19CYP3A4
SCHEMBL6670701 0.88 CALML3 (0.45) MAOAMAOBCALML3CYP2C19CYP3A4

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