SCHEMBL5456770

SCHEMBL5456770

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

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.38
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
HTT P42858 1/20 0.35
ALDH1A1 P00352 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
KDM6B O15054 1/20 0.33
KDM5C P41229 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
TRPA1 O75762 1/20 0.32

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
SCHEMBL46501 0.77 MGAM (0.41) GAAMGAMSIMGAM2HTT
SCHEMBL10693856 0.74 TDP1 (0.42) GAAALDH1A1TDP1
SCHEMBL970937 0.74 MGAM (0.39) GAAMGAMSIMGAM2HTT
SCHEMBL29640532 0.74 MGAM (0.39) GAAMGAMSIMGAM2HTT
SCHEMBL23581431 0.72 MGAM (0.38) GAAMGAMSIMGAM2HTT
SCHEMBL10824229 0.72 MGAM (0.38) GAAMGAMSIMGAM2HTT
SCHEMBL10088108 0.72 MGAM (0.38) GAAMGAMSIMGAM2HTT
SCHEMBL6232159 0.72 MGAM (0.38) GAAMGAMSIMGAM2HTT
SCHEMBL28645618 0.72 MGAM (0.38) GAAMGAMSIMGAM2HTT
SCHEMBL374099 0.71 LMNA (0.42) GAAALDH1A1TDP1KDM4E

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
US-20070293612-A1 Stabilizer Composition for Halogen-Containing Thermoplastic Resin Compositions BAERLOCHER GMBH (DE) 2007-12-20 US disclosed