SCHEMBL13428581

SCHEMBL13428581

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

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 9/20 0.62
MAOB P27338 5/20 0.56
MAOA P21397 5/20 0.56
LMNA P02545 1/20 0.56
PTGS1 P23219 1/20 0.56
CALML3 P27482 1/20 0.56
SDHA P31040 1/20 0.56

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
SCHEMBL13428813 0.91 F10 (0.59) F10MAOBMAOALMNAPTGS1
SCHEMBL13054893 0.88 F10 (0.66) F10MAOBMAOALMNAPTGS1
SCHEMBL13159169 0.86 MAOB (0.66) F10MAOBMAOALMNAPTGS1
SCHEMBL2088204 0.86 MAOA (0.71) F10MAOBMAOALMNAPTGS1
SCHEMBL3753257 0.86 MAOA (0.71) F10MAOBMAOALMNAPTGS1
SCHEMBL13101206 0.85 MAOB (0.51) F10MAOBMAOALMNAPTGS1
SCHEMBL10152699 0.85 MAOB (0.65) F10MAOBMAOALMNAPTGS1
SCHEMBL7710101 0.85 MAOB (0.61) F10MAOBMAOALMNAPTGS1
SCHEMBL7710097 0.85 MAOB (0.61) F10MAOBMAOALMNAPTGS1
SCHEMBL13428400 0.85 MAOB (0.54) F10MAOBMAOALMNAPTGS1

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