SCHEMBL16686193

SCHEMBL16686193

C[C@@](C[C@H]1CN(c2ccc(Br)c(F)c2F)C(=O)O1)(C(=O)O)S(C)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.36
MAOA P21397 4/20 0.36
GRM2 Q14416 1/20 0.35
LMNA P02545 1/20 0.34
PTGS1 P23219 1/20 0.34
CALML3 P27482 1/20 0.34
SDHA P31040 1/20 0.34

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
SCHEMBL16686195 1.00 MAOB (0.36) MAOBMAOAGRM2LMNAPTGS1
SCHEMBL16685890 0.85 MAOB (0.34) MAOBMAOAGRM2LMNAPTGS1
SCHEMBL16685889 0.85 MAOB (0.34) MAOBMAOAGRM2LMNAPTGS1
SCHEMBL16685922 0.85 MAOB (0.41) MAOBMAOAGRM2LMNAPTGS1
SCHEMBL16687306 0.85 MAOB (0.41) MAOBMAOAGRM2LMNAPTGS1
SCHEMBL16685920 0.85 MAOB (0.41) MAOBMAOAGRM2LMNAPTGS1
SCHEMBL16685566 0.83 MAOB (0.45) MAOBMAOALMNAPTGS1CALML3
SCHEMBL16685567 0.83 MAOB (0.45) MAOBMAOALMNAPTGS1CALML3
SCHEMBL16685837 0.82 F10 (0.36) MAOBMAOAGRM2
SCHEMBL16685839 0.82 F10 (0.36) MAOBMAOAGRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015066413-A1 OXAZOLIDINONE HYDROXAMIC ACID COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS NOVARTIS AG (CH) 2015-05-07 WO disclosed