SCHEMBL6611528

SCHEMBL6611528

CC(C)=CC(=O)N1CCN(c2ccc(-c3ccc(N4C[C@H](CCC(N)=O)OC4=O)cc3F)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 10/20 0.48
CYP2C19 P33261 2/20 0.47
CYP2C9 P11712 1/20 0.47
CALML3 P27482 6/20 0.47
MAOB P27338 2/20 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
SCHEMBL6611534 1.00 MAOA (0.48) MAOACYP2C19CYP2C9CALML3MAOB
SCHEMBL6647521 0.92 CALML3 (0.47) MAOACYP2C19CYP2C9CALML3MAOB
SCHEMBL6797439 0.92 CYP2C19 (0.49) MAOACYP2C19CYP2C9CALML3MAOB
SCHEMBL6795457 0.92 MAOA (0.53) MAOACYP2C19CYP2C9CALML3MAOB
SCHEMBL6796197 0.91 CYP2C19 (0.47) MAOACYP2C19CYP2C9CALML3MAOB
SCHEMBL6624388 0.88 CALML3 (0.48) MAOACYP2C19CYP2C9CALML3MAOB
SCHEMBL6669916 0.88 MAOA (0.48) MAOACYP2C19CYP2C9CALML3MAOB
SCHEMBL6611525 0.87 MAOA (0.56) MAOACYP2C19CYP2C9CALML3MAOB
SCHEMBL6642127 0.87 CALML3 (0.49) MAOACYP2C19CYP2C9CALML3MAOB
SCHEMBL6665513 0.87 CALML3 (0.49) MAOACYP2C19CYP2C9CALML3MAOB

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