SCHEMBL8140352

SCHEMBL8140352

CC(=O)NC[C@H]1CN(c2ccc(C3=C(C(=O)OC(C)(C)C)[C@@H](CO)NC3)cc2)C(=O)O1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.45
MAOB P27338 2/20 0.45
LMNA P02545 1/20 0.45
PTGS1 P23219 1/20 0.45
CALML3 P27482 1/20 0.45
SDHA P31040 1/20 0.45
F10 P00742 3/20 0.42
ABCB11 O95342 1/20 0.41
CMA1 P23946 1/20 0.39

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
SCHEMBL8156673 1.00 MAOA (0.45) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL8158245 0.89 MAOA (0.42) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL8135134 0.88 MAOA (0.41) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL8134838 0.85 MAOA (0.39) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL8133745 0.82 MAOA (0.46) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL8140841 0.81 MAOA (0.43) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL8131776 0.77 MAOA (0.52) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL13298924 0.77 MAOA (0.61) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL8138685 0.76 MAOA (0.41) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL8553013 0.75 MAOA (0.46) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1005468-A1 ANTIBIOTIC OXAZOLIDINONE DERIVATIVES ZENECA LIMITED (GB) 2000-06-07 EP disclosed
WO-1999010342-A1 ANTIBIOTIC OXAZOLIDINONE DERIVATIVES ZENECA LIMITED (GB) 1999-03-04 WO disclosed