SCHEMBL6512668

SCHEMBL6512668

CON=c1sc2cc(N3CC(CNC(C)=O)OC3=O)ccc2n1C

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.54
MAOB P27338 3/20 0.54
PTGS1 P23219 2/20 0.54
SDHA P31040 2/20 0.54
LMNA P02545 1/20 0.54
CALML3 P27482 1/20 0.54
F10 P00742 6/20 0.46

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
SCHEMBL6512664 1.00 MAOA (0.54) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6511736 0.97 MAOA (0.51) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6532578 0.91 MAOA (0.52) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6532575 0.91 MAOA (0.52) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6532583 0.91 MAOA (0.52) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6513198 0.91 F10 (0.44) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6513194 0.91 F10 (0.44) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6514588 0.90 MAOA (0.52) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6514585 0.90 MAOA (0.52) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6516052 0.90 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA

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 2 patents. 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 claimed
WO-2005082900-A2 OXAZOLIDINONE AMIDOXIMES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2005-09-09 WO disclosed