SCHEMBL6161325

SCHEMBL6161325

NC(=S)NC[C@H]1CN(c2ccc(C3CCSC(O)(O)C3)c(F)c2)C(=O)O1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.47
MAOB P27338 5/20 0.47
F10 P00742 11/20 0.46
LMNA P02545 1/20 0.43
PTGS1 P23219 1/20 0.43
CALML3 P27482 1/20 0.43
SDHA P31040 1/20 0.43

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
SCHEMBL6162599 0.92 MAOA (0.53) MAOAMAOBF10LMNAPTGS1
SCHEMBL8118953 0.89 MAOA (0.50) MAOAMAOBF10LMNAPTGS1
SCHEMBL8109073 0.87 MAOA (0.47) MAOAMAOBF10LMNAPTGS1
SCHEMBL6161671 0.87 MAOA (0.48) MAOAMAOBF10LMNAPTGS1
SCHEMBL6163888 0.84 MAOA (0.48) MAOAMAOBF10LMNAPTGS1
SCHEMBL6163251 0.84 MAOA (0.48) MAOAMAOBF10LMNAPTGS1
SCHEMBL7208997 0.84 MAOA (0.48) MAOAMAOBF10LMNAPTGS1
SCHEMBL6162164 0.83 MAOA (0.42) MAOAMAOBF10LMNAPTGS1
SCHEMBL7157309 0.81 MAOA (0.56) MAOAMAOBF10LMNAPTGS1
SCHEMBL6161441 0.81 MAOA (0.53) MAOAMAOBF10LMNAPTGS1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0984947-B8 OXAZOLIDINONE ANTIBACTERIAL AGENTS HAVING A THIOCARBONYL FUNCTIONALITY PHARMACIA & UPJOHN CO LLC (US) 2005-06-15 EP disclosed
EP-0984947-A1 OXAZOLIDINONE ANTIBACTERIAL AGENTS HAVING A THIOCARBONYL FUNCTIONALITY PHARMACIA & UPJOHN COMPANY (US) 2000-03-15 EP disclosed
WO-1998054161-A9 OXAZOLIDINONE ANTIBACTERIAL AGENTS HAVING A THIOCARBONYL FUNCTIONALITY UPJOHN CO (US) 1999-04-08 WO disclosed
WO-1998054161-A1 OXAZOLIDINONE ANTIBACTERIAL AGENTS HAVING A THIOCARBONYL FUNCTIONALITY PHARMACIA & UPJOHN COMPANY (US) 1998-12-03 WO disclosed