SCHEMBL20650993

SCHEMBL20650993

CC1(N)CC(=O)C(C)(C)N(O)C(C)(C)C1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL243699 0.78 MAPT (0.43) KDM4EALDH1A1GAAMAPTL3MBTL1
Hydrochloric Acid SCHEMBL4957370 0.76 MAPT (0.46) KDM4EALDH1A1GAAMAPTL3MBTL1
Hydrochloric Acid SCHEMBL4445454 0.74 MAPT (0.41) KDM4EALDH1A1GAAMAPTL3MBTL1
SCHEMBL7559779 0.73 GAA (0.33) GAAL3MBTL1
SCHEMBL8463169 0.68 ALDH1A1 (0.33) KDM4EALDH1A1GAAMAPTL3MBTL1
SCHEMBL289296 0.64
SCHEMBL23895142 0.63 KDM4E (0.33) KDM4EALDH1A1GAAMAPTL3MBTL1
SCHEMBL22679967 0.63 GAA (0.30) GAAL3MBTL1
SCHEMBL4438105 0.63 LMNA (0.32) KDM4EALDH1A1GAAMAPTL3MBTL1
SCHEMBL85990 0.61 GAA (0.38) KDM4EALDH1A1GAAMAPTL3MBTL1

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
EP-2838928-B1 POLYMER SERVING AS AN ELECTRODE MATERIAL FOR LITHIUM SECONDARY BATTERIES COMMISSARIAT ENERGIE ATOMIQUE (FR) 2019-01-16 EP disclosed