SCHEMBL6532044

SCHEMBL6532044

CON=C1N(C)c2ccc(N3CC(CNC(=O)OC(C)(C)C)OC3=O)cc2C1(F)F

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.45
MAOA P21397 4/20 0.45
PTGS1 P23219 2/20 0.45
SDHA P31040 2/20 0.45
LMNA P02545 1/20 0.45
CALML3 P27482 1/20 0.45
F10 P00742 12/20 0.45

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
SCHEMBL6532041 1.00 MAOB (0.45) MAOBMAOAPTGS1SDHALMNA
Lithium Ion SCHEMBL6529894 0.97 F10 (0.43) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6529220 0.93 MAOA (0.46) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6529223 0.93 MAOA (0.46) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6528609 0.89 MAOA (0.54) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6528613 0.89 MAOA (0.54) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6530878 0.89 MAOA (0.54) MAOBMAOAPTGS1SDHALMNA
Lithium Ion SCHEMBL6531166 0.88 MAOA (0.50) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6533404 0.88 MAOB (0.45) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6533407 0.88 MAOB (0.45) 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-2005082900-A2 OXAZOLIDINONE AMIDOXIMES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2005-09-09 WO disclosed