SCHEMBL6510916

SCHEMBL6510916

CCON=c1sc2cc(N3C[C@H](CNC(=O)CC)OC3=O)ccc2n1CC

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.43
MAOB P27338 2/20 0.43
F10 P00742 17/20 0.42
F2 P00734 1/20 0.42
THRB P10828 1/20 0.42
LMNA P02545 1/20 0.42
PTGS1 P23219 1/20 0.42
CALML3 P27482 1/20 0.42
SDHA P31040 1/20 0.42

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
SCHEMBL6510924 1.00 MAOA (0.43) MAOAMAOBF10F2THRB
SCHEMBL6511621 0.92 MAOA (0.51) MAOAMAOBF10LMNAPTGS1
SCHEMBL6511624 0.92 MAOA (0.51) MAOAMAOBF10LMNAPTGS1
SCHEMBL6511456 0.92 F10 (0.44) MAOAMAOBF10F2THRB
SCHEMBL6511460 0.92 F10 (0.44) MAOAMAOBF10F2THRB
SCHEMBL6508866 0.92 MAOB (0.43) MAOAMAOBF10F2LMNA
SCHEMBL6508870 0.92 MAOB (0.43) MAOAMAOBF10F2LMNA
SCHEMBL6515852 0.91 MAOA (0.49) MAOAMAOBF10F2LMNA
SCHEMBL6511928 0.89 F10 (0.45) MAOAMAOBF10F2THRB
SCHEMBL6511927 0.89 F10 (0.45) MAOAMAOBF10F2THRB

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