SCHEMBL1406753

SCHEMBL1406753

CCOC(=O)CC(CC(=O)O)(C(C)=O)C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 2/20 0.39
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
ALDH1A1 P00352 5/20 0.36
TRPA1 O75762 1/20 0.36
PKM P14618 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35
THRB P10828 1/20 0.35
PTPN1 P18031 1/20 0.35
PTPRB P23467 1/20 0.35
ACP1 P24666 1/20 0.35
EGLN1 Q9GZT9 1/20 0.34
HTT P42858 1/20 0.34
CYP1A2 P05177 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33

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
SCHEMBL27614238 0.93 MEN1 (0.44) MEN1KMT2AGAAMGAMSI
SCHEMBL9630686 0.85 MEN1 (0.42) MEN1KMT2AALDH1A1PKMKDM4E
SCHEMBL10992850 0.82 GAA (0.50) MEN1KMT2AGAAMGAMSI
SCHEMBL27918078 0.82 MEN1 (0.48) MEN1KMT2AGAAMGAMSI
SCHEMBL4163475 0.82 MEN1 (0.43) MEN1KMT2AGAAMGAMSI
SCHEMBL1406640 0.81 PKM (0.42) MEN1KMT2AGAAMGAMSI
SCHEMBL27685082 0.81 GAA (0.44) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL11432705 0.79 MEN1 (0.46) MEN1KMT2AGAAMGAMSI
SCHEMBL3003335 0.78 MEN1 (0.42) MEN1KMT2AGAAMGAMSI
SCHEMBL4740313 0.76 MEN1 (0.43) MEN1KMT2AGAAMGAMSI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490412-B1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK & CHEMICALS (JP) 2011-03-09 EP disclosed
US-7166648-B2 Photoinitiator, novel compound, and photocurable composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-01-23 US disclosed
US-20050256218-A1 Photoinitiator, novel compound, and photocurable composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-11-17 US disclosed
EP-1490412-A1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-12-29 EP disclosed
WO-2003082929-A1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-10-09 WO disclosed