SCHEMBL6618347

SCHEMBL6618347

CC(=S)NC[C@H]1CN(c2ccc(C3C=CSC(O)C3)c(F)c2)C(=O)O1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.51
MAOB P27338 4/20 0.51
LMNA P02545 1/20 0.50
PTGS1 P23219 1/20 0.50
CALML3 P27482 1/20 0.50
SDHA P31040 1/20 0.50
F10 P00742 10/20 0.46

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
SCHEMBL6618705 0.92 MAOA (0.59) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL5216142 0.85 MAOA (0.54) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6160348 0.81 MAOA (0.54) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7832146 0.81 MAOA (0.54) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6164089 0.81 MAOA (0.54) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7846895 0.81 MAOA (0.54) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL5214900 0.79 MAOA (0.49) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6040235 0.79 MAOA (0.53) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6040232 0.79 MAOA (0.54) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6040230 0.79 MAOA (0.53) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1467992-A1 ANTIMICROBIAL DIHYDROTHIAZINE AND DIHYDROTHIOPYRAN OXAZOLIDINONES PHARMACIA & UPJOHN COMPANY (US) 2004-10-20 EP claimed
WO-2003062231-A1 ANTIMICROBIAL DIHYDROTHIAZINE AND DIHYDROTHIOPYRAN OXAZOLIDINONES PHARMACIA & UPJOHN COMPANY (US) 2003-07-31 WO claimed
EP-1467992-A1 ANTIMICROBIAL DIHYDROTHIAZINE AND DIHYDROTHIOPYRAN OXAZOLIDINONES PHARMACIA & UPJOHN COMPANY (US) 2004-10-20 EP disclosed
WO-2003062231-A1 ANTIMICROBIAL DIHYDROTHIAZINE AND DIHYDROTHIOPYRAN OXAZOLIDINONES PHARMACIA & UPJOHN COMPANY (US) 2003-07-31 WO disclosed