SCHEMBL13428394

SCHEMBL13428394

CCOC(=O)CNNCNc1ccc(N2C[C@H](CNC(C)=O)OC2=O)cc1F

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.57
MAOB P27338 3/20 0.57
PTGS1 P23219 2/20 0.57
SDHA P31040 2/20 0.57
LMNA P02545 1/20 0.57
CALML3 P27482 1/20 0.57
F10 P00742 4/20 0.49
TOP2B Q02880 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
SCHEMBL13428639 0.91 MAOB (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13428249 0.90 MAOA (0.62) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13428373 0.89 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13428443 0.86 MAOA (0.65) MAOAMAOBPTGS1SDHALMNA
SCHEMBL12527868 0.86 MAOA (0.67) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13428439 0.85 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13428219 0.84 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13428548 0.84 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13428146 0.84 MAOA (0.60) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13428673 0.84 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010036000-A2 NOVEL OXAZOLIDINONE DERIVATIVES WITH CYCLIC AMIDOXIME OR CYCLIC AMIDRAZONE AND PHARMACEUTICAL COMPOSITIONS THEREOF LEGOCHEM BIOSCIENCE LTD. (KR) 2010-04-01 WO disclosed