SCHEMBL5329977

SCHEMBL5329977

COC1CN(c2c(F)cc(N3C[C@H](CNC(=O)O)OC3=O)cc2F)C1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.51
MAOB P27338 4/20 0.51
PTGS1 P23219 2/20 0.51
SDHA P31040 2/20 0.51
LMNA P02545 1/20 0.51
CALML3 P27482 1/20 0.51
F10 P00742 4/20 0.45

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
SCHEMBL5328079 0.93 MAOA (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5329301 0.90 MAOA (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5326899 0.90 MAOA (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5281829 0.87 MAOA (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5301829 0.87 MAOA (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5325706 0.86 MAOA (0.48) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5286908 0.84 MAOA (0.46) MAOAMAOBPTGS1SDHALMNA
SCHEMBL17975528 0.82 MAOA (0.50) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5285317 0.82 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
SCHEMBL17975531 0.82 MAOA (0.50) MAOAMAOBPTGS1SDHALMNA

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-2007004049-A1 OXAZOLIDINONES CONTAINING AZETIDINE AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2007-01-11 WO disclosed