SCHEMBL7698405

SCHEMBL7698405

CC(=O)NC[C@H]1CN(c2ccc(C3=CCS(=O)(=NS(C)(=O)=O)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 15/20 0.77
MAOB P27338 2/20 0.51
LMNA P02545 1/20 0.51
PTGS1 P23219 1/20 0.51
CALML3 P27482 1/20 0.51
SDHA P31040 1/20 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
SCHEMBL7696828 0.88 MAOA (0.77) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL5218335 0.87 MAOA (1.00) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7694226 0.86 MAOA (0.75) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7695189 0.86 MAOA (0.85) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7689362 0.86 MAOA (0.74) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL5218343 0.85 MAOA (0.84) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL5218330 0.85 MAOA (0.84) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7696844 0.85 MAOA (0.73) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6398400 0.82 MAOA (0.78) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6396636 0.82 MAOA (0.84) MAOAMAOBLMNAPTGS1CALML3

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-2002080841-A2 ANTIBACTERIAL OXAZOLIDINONES WITH A CYCLIC SULPHILIMINE OR SULPHOXIMINE ASTRAZENECA AB (SE) 2002-10-17 WO claimed