SCHEMBL13428648

SCHEMBL13428648

Nc1ccc(N2C[C@H](CNC(=O)C(F)F)OC2=O)cc1F

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 10/20 0.66
MAOA P21397 5/20 0.55
MAOB P27338 4/20 0.55
LMNA P02545 1/20 0.55
PTGS1 P23219 1/20 0.55
CALML3 P27482 1/20 0.55
SDHA P31040 1/20 0.55

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
SCHEMBL13428554 0.90 F10 (0.68) F10MAOAMAOBLMNAPTGS1
SCHEMBL12956275 0.89 MAOA (0.55) F10MAOAMAOBLMNAPTGS1
SCHEMBL1034798 0.88 MAOA (0.54) F10MAOAMAOBLMNAPTGS1
SCHEMBL1034799 0.88 MAOA (0.54) F10MAOAMAOBLMNAPTGS1
SCHEMBL3758607 0.88 F10 (0.70) F10MAOAMAOBLMNAPTGS1
SCHEMBL2088204 0.87 MAOA (0.71) F10MAOAMAOBLMNAPTGS1
SCHEMBL3753257 0.87 MAOA (0.71) F10MAOAMAOBLMNAPTGS1
SCHEMBL12956100 0.85 MAOA (0.50) F10MAOAMAOBLMNAPTGS1
SCHEMBL6490054 0.85 MAOB (0.58) F10MAOAMAOBLMNAPTGS1
SCHEMBL6337000 0.85 MAOB (0.58) F10MAOAMAOBLMNAPTGS1

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