SCHEMBL6163072

SCHEMBL6163072

NCC1CN(c2ccc([C@@H]3CCS[C@H](O)C3)c(F)c2)C(=O)O1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.48
CALML3 P27482 6/20 0.43
MAOB P27338 3/20 0.42
F10 P00742 4/20 0.41

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
SCHEMBL5215517 1.00 MAOA (0.48) MAOACALML3MAOBF10
SCHEMBL6164118 1.00 MAOA (0.48) MAOACALML3MAOBF10
SCHEMBL8118062 1.00 MAOA (0.48) MAOACALML3MAOBF10
SCHEMBL7816976 0.91 CALML3 (0.53) MAOACALML3MAOBF10
SCHEMBL6163251 0.86 MAOA (0.48) MAOACALML3MAOBF10
SCHEMBL6163888 0.86 MAOA (0.48) MAOACALML3MAOBF10
SCHEMBL7208997 0.86 MAOA (0.48) MAOACALML3MAOBF10
SCHEMBL6161896 0.86 MAOA (0.43) MAOACALML3MAOBF10
SCHEMBL6161892 0.86 MAOA (0.43) MAOACALML3MAOBF10
SCHEMBL6161988 0.86 MAOA (0.43) MAOACALML3MAOBF10

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 6 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-1133493-A1 OXAZOLIDINONE ANTIBACTERIAL AGENTS HAVING A THIOCARBONYL FUNCTIONALITY PHARMACIA & UPJOHN COMPANY (US) 2001-09-19 EP disclosed
WO-2000032599-A1 OXAZOLIDINONE ANTIBACTERIAL AGENTS HAVING A THIOCARBONYL FUNCTIONALITY PHARMACIA & UPJOHN COMPANY (US) 2000-06-08 WO 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