SCHEMBL13428400

SCHEMBL13428400

COC(=S)NC[C@H]1CN(c2ccc(N/C=N\N)c(F)c2)C(=O)O1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.54
MAOA P21397 4/20 0.54
LMNA P02545 1/20 0.54
PTGS1 P23219 1/20 0.54
CALML3 P27482 1/20 0.54
SDHA P31040 1/20 0.54
F10 P00742 8/20 0.51

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
SCHEMBL13428666 0.88 MAOA (0.67) MAOBMAOALMNAPTGS1CALML3
SCHEMBL13428581 0.85 F10 (0.62) MAOBMAOALMNAPTGS1CALML3
SCHEMBL13428653 0.83 CALML3 (0.56) MAOBMAOALMNAPTGS1CALML3
SCHEMBL11982904 0.83 MAOB (0.54) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7710101 0.82 MAOB (0.61) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7710097 0.82 MAOB (0.61) MAOBMAOALMNAPTGS1CALML3
SCHEMBL13428278 0.81 F10 (0.51) MAOBMAOALMNAPTGS1CALML3
SCHEMBL13159169 0.81 MAOB (0.66) MAOBMAOALMNAPTGS1CALML3
SCHEMBL10152699 0.80 MAOB (0.65) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7710010 0.80 MAOB (0.61) MAOBMAOALMNAPTGS1CALML3

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