SCHEMBL1406347

SCHEMBL1406347

CCOC(=O)C(CCCC(=O)OC)(C(C)=O)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.42
PKM P14618 2/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTPRB P23467 1/20 0.37
CYP1A2 P05177 1/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 2/20 0.36
CYP4F2 P78329 2/20 0.35
CYP4A11 Q02928 2/20 0.35
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 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
SCHEMBL1406736 0.80 THRB (0.42) TSHRPKMTHRBHTTATM
SCHEMBL25697482 0.79 TSHR (0.44) TSHRPKMTHRBHTTATM
SCHEMBL27803622 0.79 CYP1A2 (0.47) TSHRPKMTHRBHTTATM
SCHEMBL1406411 0.76 CYP1A2 (0.42) TSHRPKMTHRBHTTATM
SCHEMBL25761564 0.76 TSHR (0.47) TSHRPKMTHRBHTTATM
SCHEMBL28753773 0.74 THRB (0.40) TSHRPKMTHRBHTTATM
SCHEMBL6470018 0.74 MEN1 (0.36) TSHRPKMTHRBHTTATM
SCHEMBL24228618 0.73 MEN1 (0.43) TSHRPKMTHRBHTTATM
SCHEMBL12809724 0.73 CYP1A2 (0.44) TSHRPKMTHRBHTTATM
SCHEMBL1406452 0.73 CYP1A2 (0.42) TSHRPKMTHRBHTTATM

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 7 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
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