SCHEMBL6648595

SCHEMBL6648595

CCC(=O)NC1CN(c2ccc(-c3ccc(N4CCN(C(=O)Cc5cc(OC)ccc5OC)CC4)nc3)c(F)c2)C(=O)O1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOA P21397 9/20 0.40
CYP2C19 P33261 2/20 0.38
CYP3A4 P08684 1/20 0.38
RET P07949 1/20 0.38
CALML3 P27482 5/20 0.38
MAOB P27338 2/20 0.38
CYP2C9 P11712 1/20 0.37
ROCK2 O75116 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL6669476 0.86 MAOA (0.44) MAOACYP2C19CYP3A4RETCALML3
SCHEMBL6791765 0.86 MAOA (0.49) MAOACYP2C19CYP3A4CALML3MAOB
SCHEMBL27592343 0.86 MAOA (0.41) MAOACYP2C19CYP3A4RETCALML3
SCHEMBL27592341 0.86 MAOA (0.41) MAOACYP2C19CYP3A4RETCALML3
SCHEMBL6673605 0.86 MAOA (0.44) MAOACYP2C19CYP3A4CALML3MAOB
SCHEMBL6672138 0.86 CALML3 (0.46) MAOACYP2C19CYP3A4CALML3MAOB
SCHEMBL6667976 0.85 CALML3 (0.44) MAOACYP2C19CYP3A4RETCALML3
SCHEMBL6791770 0.85 MAOA (0.43) MAOACYP2C19CYP3A4CALML3MAOB
SCHEMBL6640795 0.85 MAOA (0.42) MAOACYP2C19CYP3A4RETCALML3
SCHEMBL6694501 0.84 MAOA (0.48) MAOACYP2C19CYP3A4CALML3MAOB

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