SCHEMBL6643604

SCHEMBL6643604

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

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.45
CYP2C9 P11712 1/20 0.45
CALML3 P27482 6/20 0.44
CYP3A4 P08684 1/20 0.44
MAOA P21397 11/20 0.44
MAOB P27338 2/20 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
SCHEMBL6694501 0.89 MAOA (0.48) CYP2C19CYP2C9CALML3CYP3A4MAOA
SCHEMBL6624481 0.89 CALML3 (0.47) CYP2C19CYP2C9CALML3CYP3A4MAOA
SCHEMBL6665916 0.88 MAOA (0.47) CYP2C19CYP2C9CALML3CYP3A4MAOA
SCHEMBL6672138 0.88 CALML3 (0.46) CYP2C19CYP2C9CALML3CYP3A4MAOA
SCHEMBL6673605 0.88 MAOA (0.44) CYP2C19CYP2C9CALML3CYP3A4MAOA
SCHEMBL6670663 0.87 CYP2C19 (0.45) CYP2C19CYP2C9CALML3CYP3A4MAOA
SCHEMBL6670701 0.87 CALML3 (0.45) CYP2C19CYP2C9CALML3CYP3A4MAOA
SCHEMBL6643307 0.86 MAOA (0.43) CYP2C19CYP2C9CALML3CYP3A4MAOA
SCHEMBL6646861 0.86 CYP2C19 (0.46) CYP2C19CYP2C9CALML3CYP3A4MAOA
SCHEMBL6671966 0.86 MAOA (0.47) CYP2C19CYP2C9CALML3CYP3A4MAOA

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