SCHEMBL5704707

SCHEMBL5704707

N[C@H](C[C@@H](F)C(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.54
SLC1A1 P43005 4/20 0.50
FOLH1 Q04609 5/20 0.48
SLC1A3 P43003 4/20 0.48
SLC1A2 P43004 4/20 0.48
PTGS1 P23219 1/20 0.46
SLC7A11 Q9UPY5 1/20 0.46
GRIK1 P39086 2/20 0.45
GRIK2 Q13002 2/20 0.45
GGT1 P19440 2/20 0.44
GRM1 Q13255 1/20 0.44
GRM2 Q14416 1/20 0.44

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
SCHEMBL14677435 1.00 SLC7A5 (0.54) SLC7A5SLC1A1FOLH1SLC1A3SLC1A2
SCHEMBL5704713 1.00 SLC7A5 (0.54) SLC7A5SLC1A1FOLH1SLC1A3SLC1A2
SCHEMBL609262 1.00 SLC7A5 (0.54) SLC7A5SLC1A1FOLH1SLC1A3SLC1A2
SCHEMBL13224565 1.00 SLC7A5 (0.54) SLC7A5SLC1A1FOLH1SLC1A3SLC1A2
SCHEMBL13746294 1.00 SLC7A5 (0.54) SLC7A5SLC1A1FOLH1SLC1A3SLC1A2
SCHEMBL502878 1.00 SLC7A5 (0.54) SLC7A5SLC1A1FOLH1SLC1A3SLC1A2
SCHEMBL3471145 1.00 SLC7A5 (0.54) SLC7A5SLC1A1FOLH1SLC1A3SLC1A2
SCHEMBL13224526 1.00 SLC7A5 (0.54) SLC7A5SLC1A1FOLH1SLC1A3SLC1A2
SCHEMBL502879 1.00 SLC7A5 (0.54) SLC7A5SLC1A1FOLH1SLC1A3SLC1A2
SCHEMBL12900073 0.85 SLC7A5 (0.50) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030194378-A1 Novel aerosol formulation containing a polar fluorinated molecule ASTRAZENECA AB (SE) 2003-10-16 US claimed
EP-1303258-A1 NOVEL AEROSOL FORMULATION CONTAINING A POLAR FLUORINATED MOLECULE AstraZeneca AB (SE) 2003-04-23 EP claimed
WO-2002003958-A1 NOVEL AEROSOL FORMULATION CONTAINING A POLAR FLUORINATED MOLECULE ASTRAZENECA AB (SE) 2002-01-17 WO claimed
EP-1303258-B1 NOVEL AEROSOL FORMULATION CONTAINING A POLAR FLUORINATED MOLECULE ASTRAZENECA AB (SE) 2006-10-11 EP disclosed
US-20030194378-A1 Novel aerosol formulation containing a polar fluorinated molecule ASTRAZENECA AB (SE) 2003-10-16 US disclosed
EP-1303258-A1 NOVEL AEROSOL FORMULATION CONTAINING A POLAR FLUORINATED MOLECULE AstraZeneca AB (SE) 2003-04-23 EP disclosed
WO-2002003958-A1 NOVEL AEROSOL FORMULATION CONTAINING A POLAR FLUORINATED MOLECULE ASTRAZENECA AB (SE) 2002-01-17 WO disclosed