SCHEMBL6645340

SCHEMBL6645340

CCC(=O)NC1CN(c2ccc(-c3cnc(N4CCN(C(=O)c5ccccc5C(F)(F)F)CC4)nc3)c(F)c2)C(=O)O1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 5/20 0.43
SCD O00767 5/20 0.42
GBA1 P04062 1/20 0.41
CALML3 P27482 2/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAOA P21397 2/20 0.39
MAOB P27338 1/20 0.38
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38

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
SCHEMBL6674066 0.86 CALML3 (0.44) CALML3CYP3A4CYP2C19MAOAMAOB
SCHEMBL6666682 0.86 CALML3 (0.44) CALML3CYP3A4CYP2C19MAOAMAOB
SCHEMBL6613110 0.85 MAOA (0.52) WDR5SCDCALML3MAOAMAOB
SCHEMBL6667293 0.85 CALML3 (0.43) CALML3CYP3A4CYP2C19MAOAMAOB
SCHEMBL6642797 0.85 CALML3 (0.47) CALML3CYP3A4CYP2C19MAOAMAOB
SCHEMBL6667680 0.85 CYP3A4 (0.45) CALML3CYP3A4CYP2C19MAOAMAOB
SCHEMBL27592135 0.84 WDR5 (0.45) WDR5SCDGBA1CALML3CYP3A4
SCHEMBL27592132 0.84 WDR5 (0.45) WDR5SCDGBA1CALML3CYP3A4
SCHEMBL6672692 0.84 CALML3 (0.44) CALML3CYP3A4CYP2C19MAOAMAOB
SCHEMBL6648173 0.84 CALML3 (0.44) CALML3CYP3A4CYP2C19MAOAMAOB

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