SCHEMBL7208997

SCHEMBL7208997

NC(=S)NCC1CN(c2ccc(C3CCSC(O)C3)c(F)c2)C(=O)O1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.48
MAOB P27338 5/20 0.47
F10 P00742 11/20 0.47
LMNA P02545 1/20 0.44
PTGS1 P23219 1/20 0.44
CALML3 P27482 1/20 0.44
SDHA P31040 1/20 0.44

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
SCHEMBL6163888 1.00 MAOA (0.48) MAOAMAOBF10LMNAPTGS1
SCHEMBL6163251 1.00 MAOA (0.48) MAOAMAOBF10LMNAPTGS1
SCHEMBL7846895 0.91 MAOA (0.54) MAOAMAOBF10LMNAPTGS1
SCHEMBL6164089 0.91 MAOA (0.54) MAOAMAOBF10LMNAPTGS1
SCHEMBL6160348 0.91 MAOA (0.54) MAOAMAOBF10LMNAPTGS1
SCHEMBL7832146 0.91 MAOA (0.54) MAOAMAOBF10LMNAPTGS1
SCHEMBL8108944 0.89 MAOA (0.51) MAOAMAOBF10LMNAPTGS1
SCHEMBL6160328 0.89 MAOA (0.61) MAOAMAOBF10LMNAPTGS1
SCHEMBL7195331 0.89 MAOA (0.61) MAOAMAOBF10LMNAPTGS1
SCHEMBL6160326 0.89 MAOA (0.61) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1274426-A2 USE OF THIOAMIDE OXAZOLIDINONES FOR THE TREATMENT OF BONE RESORPTION AND OSTEOPOROSIS PHARMACIA & UPJOHN COMPANY (US) 2003-01-15 EP claimed
WO-2001080841-A2 USE OF THIOAMIDE OXAZOLIDINONES FOR THE TREATMENT OF BONE RESORPTION AND OSTEOPOROSIS PHARMACIA & UPJOHN COMPANY (US) 2001-11-01 WO claimed