SCHEMBL1171389

SCHEMBL1171389

C=CC(C)(OC(C)=O)C(C(C)=O)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31

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
SCHEMBL21847351 0.78 GAA (0.37) GAA
SCHEMBL8003162 0.73 GAA (0.33) GAA
SCHEMBL10962327 0.71 ALDH1A1 (0.32)
SCHEMBL11389461 0.69 GAA (0.34) GAA
SCHEMBL27977109 0.69 GAA (0.44) GAA
SCHEMBL11325377 0.68 GAA (0.32) GAA
SCHEMBL11325373 0.68 GAA (0.32) GAA
SCHEMBL5606283 0.66 GAA (0.41) GAA
SCHEMBL1270028 0.66
SCHEMBL16620222 0.66 CTSK (0.38) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8648157-B2 Metal-containing compositions PRYOG, LLC (US) 2014-02-11 US claimed
US-20110092653-A1 Metal-Containing Compositions HYBRID PLASTICS, INC. 2011-04-21 US claimed
US-7888441-B2 Metal-containing compositions PRYOG, LLC (US) 2011-02-15 US claimed
US-20080045682-A1 Metal-Containing Compositions HYBRID PLASTICS, INC. 2008-02-21 US claimed
WO-2006065660-A2 METAL-CONTAINING COMPOSITIONS HYBRID PLASTICS, INC. (US) 2006-06-22 WO claimed
US-8648157-B2 Metal-containing compositions PRYOG, LLC (US) 2014-02-11 US disclosed
US-20110092653-A1 Metal-Containing Compositions HYBRID PLASTICS, INC. 2011-04-21 US disclosed
US-7888441-B2 Metal-containing compositions PRYOG, LLC (US) 2011-02-15 US disclosed
US-20080045682-A1 Metal-Containing Compositions HYBRID PLASTICS, INC. 2008-02-21 US disclosed
WO-2006065660-A2 METAL-CONTAINING COMPOSITIONS HYBRID PLASTICS, INC. (US) 2006-06-22 WO disclosed