SCHEMBL6515809

SCHEMBL6515809

CCON=c1oc2cc(N3C[C@H](CNC(C)=O)OC3=O)ccc2n1C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.49
MAOB P27338 2/20 0.49
PTGS1 P23219 2/20 0.49
SDHA P31040 2/20 0.49
LMNA P02545 1/20 0.49
CALML3 P27482 1/20 0.49
ABCB11 O95342 1/20 0.42
F10 P00742 2/20 0.42
TOP2B Q02880 1/20 0.41
CMA1 P23946 1/20 0.40
ITGB3 P05106 1/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
ITGA2B P08514 1/20 0.39
PRSS3 P35030 1/20 0.39

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
SCHEMBL6515814 1.00 MAOA (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6513956 0.91 MAOA (0.48) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6513963 0.91 MAOA (0.48) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6515812 0.91 MAOA (0.51) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6515817 0.91 MAOA (0.51) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6510940 0.88 MAOA (0.53) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6510933 0.88 MAOA (0.53) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6514783 0.84 F10 (0.42) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6514786 0.84 F10 (0.42) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6511851 0.84 MAOA (0.53) 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 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