SCHEMBL13428676

SCHEMBL13428676

CCN1CCN(c2ccc(N3CC(CO)OC3=O)cc2F)C=N1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.61
CALML3 P27482 7/20 0.53
MAOB P27338 9/20 0.48
LMNA P02545 1/20 0.48
PTGS1 P23219 1/20 0.48
SDHA P31040 1/20 0.48
CYP2C19 P33261 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP3A4 P08684 1/20 0.44

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
SCHEMBL11969165 1.00 MAOA (0.61) MAOACALML3MAOBLMNAPTGS1
Delpazolid SCHEMBL14354106 0.88 MAOA (0.77) MAOACALML3MAOBLMNAPTGS1
Delpazolid SCHEMBL11969210 0.88 MAOA (0.77) MAOACALML3MAOBLMNAPTGS1
SCHEMBL11969166 0.88 MAOA (0.57) MAOACALML3MAOBLMNAPTGS1
SCHEMBL13428774 0.87 MAOA (0.81) MAOACALML3MAOBLMNAPTGS1
SCHEMBL11968846 0.87 MAOA (0.81) MAOACALML3MAOBLMNAPTGS1
SCHEMBL12527568 0.86 MAOA (0.55) MAOACALML3MAOBLMNAPTGS1
SCHEMBL12527579 0.86 MAOA (0.57) MAOACALML3MAOBLMNAPTGS1
SCHEMBL12527576 0.86 MAOA (0.56) MAOACALML3MAOBLMNAPTGS1
SCHEMBL12528367 0.86 MAOA (0.56) MAOACALML3MAOBLMNAPTGS1

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