SCHEMBL4391789

SCHEMBL4391789

NC(=O)OC1CN(c2ccc(N3CCCOCC3)c(F)c2)C(=O)O1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.57
MAOA P21397 7/20 0.57
PTGS1 P23219 2/20 0.57
SDHA P31040 2/20 0.57
LMNA P02545 1/20 0.57
CALML3 P27482 1/20 0.57
F10 P00742 4/20 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
SCHEMBL4386333 0.88 MAOB (0.59) MAOBMAOAPTGS1SDHALMNA
SCHEMBL4381299 0.87 MAOA (0.67) MAOBMAOAPTGS1SDHALMNA
SCHEMBL4388934 0.87 MAOA (0.45) MAOBMAOAPTGS1SDHALMNA
SCHEMBL4379493 0.86 MAOA (0.68) MAOBMAOAPTGS1SDHALMNA
SCHEMBL13633151 0.86 MAOA (0.68) MAOBMAOAPTGS1SDHALMNA
SCHEMBL28116313 0.83 MAOB (0.63) MAOBMAOAPTGS1SDHALMNA
SCHEMBL12006737 0.83 MAOB (0.63) MAOBMAOAPTGS1SDHALMNA
SCHEMBL3042307 0.81 MAOA (0.73) MAOBMAOAPTGS1SDHALMNA
SCHEMBL27373749 0.81 MAOB (0.62) MAOBMAOAPTGS1SDHALMNA
SCHEMBL4380980 0.81 MAOA (0.50) 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
EP-1899331-B1 HOMOMORPHOLINE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN CO LLC (US) 2009-11-25 EP claimed