SCHEMBL5570309

SCHEMBL5570309

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 1/20 0.45
LMNA P02545 4/20 0.43
SLC15A2 Q16348 1/20 0.43
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
THRB P10828 1/20 0.41
KMT2A Q03164 1/20 0.41
ESR1 P03372 1/20 0.41
CYP3A4 P08684 1/20 0.41
ESR2 Q92731 1/20 0.41
EGLN1 Q9GZT9 2/20 0.40
ALKBH5 Q6P6C2 1/20 0.40
SUCNR1 Q9BXA5 1/20 0.40
FFAR3 O14843 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
TSHR P16473 3/20 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
SCHEMBL11311863 0.79 NAALAD2 (0.45) NAALAD2LMNASLC15A2ALDH1A1MEN1
SCHEMBL11514765 0.79 NAALAD2 (0.45) NAALAD2LMNASLC15A2ALDH1A1MEN1
SCHEMBL1406211 0.76 LMNA (0.46) NAALAD2LMNASLC15A2ALDH1A1MEN1
SCHEMBL11620113 0.76 LMNA (0.46) NAALAD2LMNASLC15A2ALDH1A1MEN1
Acetic Acid SCHEMBL4630329 0.76 NAALAD2 (0.46) NAALAD2LMNASLC15A2ALDH1A1MEN1
SCHEMBL27572737 0.75 NAALAD2 (0.42) NAALAD2LMNASLC15A2ALDH1A1MEN1
SCHEMBL11271578 0.75 NAALAD2 (0.42) NAALAD2LMNASLC15A2ALDH1A1MEN1
SCHEMBL11529406 0.75 NAALAD2 (0.50) NAALAD2LMNASLC15A2ALDH1A1MEN1
SCHEMBL15100349 0.75 NAALAD2 (0.50) NAALAD2LMNASLC15A2ALDH1A1MEN1
SCHEMBL120318 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100473667-C Photoinitiator, novel compound and photocurable composition DAINIPPON INK & CHEMICALS (JP) 2009-04-01 CN 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
CN-1642992-A Photoinitiator, photocurable composition of novel compound DAINIPPON INK & CHEMICALS (JP) 2005-07-20 CN 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