SCHEMBL13428565

SCHEMBL13428565

O=C(NC[C@H]1CN(c2ccc(N3CCNNC3)c(F)c2)C(=O)O1)C(F)F

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.58
MAOA P21397 4/20 0.58
PTGS1 P23219 2/20 0.58
SDHA P31040 2/20 0.58
LMNA P02545 1/20 0.58
CALML3 P27482 1/20 0.58
F10 P00742 13/20 0.57

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
SCHEMBL5727147 0.90 F10 (0.70) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5727141 0.90 F10 (0.70) MAOBMAOAPTGS1SDHALMNA
SCHEMBL11982941 0.89 MAOA (0.73) MAOBMAOAPTGS1SDHALMNA
SCHEMBL13428097 0.87 MAOB (0.62) MAOBMAOAPTGS1SDHALMNA
SCHEMBL13368055 0.86 MAOB (0.64) MAOBMAOAPTGS1SDHALMNA
SCHEMBL10151828 0.85 MAOB (0.60) MAOBMAOAPTGS1SDHALMNA
SCHEMBL13357980 0.85 F10 (0.47) MAOBMAOAPTGS1SDHALMNA
SCHEMBL13428280 0.85 MAOB (0.60) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6730699 0.84 F10 (0.60) MAOBMAOAPTGS1SDHALMNA
SCHEMBL10151522 0.84 MAOA (0.80) MAOBMAOAPTGS1SDHALMNA

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