SCHEMBL6674415

SCHEMBL6674415

O=C(NC[C@H]1CN(c2ccc(N3CCSCC3)c(F)c2)C(=O)O1)C1=CC(Cl)=CCC1=S.O=C(NC[C@H]1CN(c2ccc(N3CC[S+]([O-])CC3)c(F)c2)C(=O)O1)C1=CC(Cl)=CCC1=S

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.62
MAOB P27338 3/20 0.59
MAOA P21397 2/20 0.59
LMNA P02545 1/20 0.48
PTGS1 P23219 1/20 0.48
CALML3 P27482 1/20 0.48
SDHA P31040 1/20 0.48

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
SCHEMBL3155344 0.96 F10 (0.56) F10MAOBMAOALMNAPTGS1
SCHEMBL3150267 0.94 F10 (0.69) F10MAOBMAOALMNAPTGS1
SCHEMBL3151580 0.86 F10 (0.67) F10MAOBMAOALMNAPTGS1
SCHEMBL3151739 0.86 MAOB (0.66) F10MAOBMAOALMNAPTGS1
SCHEMBL3151481 0.86 F10 (0.57) F10MAOBMAOALMNAPTGS1
SCHEMBL3146099 0.86 MAOB (0.68) F10MAOBMAOALMNAPTGS1
SCHEMBL3152820 0.86 F10 (0.68) F10MAOBMAOALMNAPTGS1
SCHEMBL3155354 0.85 F10 (0.68) F10MAOBMAOALMNAPTGS1
SCHEMBL3154921 0.84 F10 (0.56) F10MAOBMAOALMNAPTGS1
SCHEMBL3160117 0.81 F10 (0.54) F10MAOBMAOALMNAPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1411932-A1 SUBSTITUTED OXAZOLIDINONES FOR COMBINATIONAL THERAPY Bayer HealthCare AG (DE) 2004-04-28 EP disclosed
WO-2003000256-A9 SUBSTITUTED OXAZOLIDINONES FOR COMBINATIONAL THERAPY BAYER AG (DE) 2003-02-06 WO disclosed
WO-2003000256-A1 SUBSTITUTED OXAZOLIDINONES FOR COMBINATIONAL THERAPY BAYER HEALTHCARE AG (DE) 2003-01-03 WO disclosed