SCHEMBL5284730

SCHEMBL5284730

COC1(C)CN(c2c(F)cc(N3C[C@H](CNC(C)=O)OC3=O)cc2F)C1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.55
MAOB P27338 3/20 0.55
PTGS1 P23219 2/20 0.55
SDHA P31040 2/20 0.55
LMNA P02545 1/20 0.55
CALML3 P27482 1/20 0.55
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
SCHEMBL5289276 0.89 MAOA (0.58) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5281292 0.89 MAOA (0.58) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5331555 0.88 MAOA (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6620014 0.88 MAOA (0.70) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6620020 0.88 MAOA (0.70) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5328079 0.86 MAOA (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL22689295 0.85 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5592148 0.85 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL18410778 0.85 MAOA (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL18408936 0.85 MAOA (0.59) 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 2 patents. 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 claimed
WO-2007004049-A1 OXAZOLIDINONES CONTAINING AZETIDINE AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2007-01-11 WO disclosed