SCHEMBL6350144

SCHEMBL6350144

CC(=O)O[C@](C)(C(=O)Cl)C(CF)(CF)CF

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.38

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
SCHEMBL6348804 0.77 GAA (0.37) GAA
SCHEMBL6348809 0.77 GAA (0.37) GAA
SCHEMBL23998492 0.77 GAA (0.37) GAA
SCHEMBL7805815 0.75 GAA (0.35) GAA
SCHEMBL9656486 0.66 GAA (0.42) GAA
SCHEMBL18253 0.66 GAA (0.42) GAA
SCHEMBL13518714 0.66
SCHEMBL8648502 0.64 GAA (0.41) GAA
SCHEMBL452395 0.64
SCHEMBL2266278 0.64 GAA (0.41) GAA

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
US-6960688-B2 Use of compounds for the elevation of pyruvate dehydrogenase activity ASTRAZENECA AB (SE) 2005-11-01 US disclosed
US-6498275-B1 Use of compounds for the elevation of pyruvate dehydrogenase activity ASTRAZENECA AB (SE) 2002-12-24 US disclosed