SCHEMBL1406736

SCHEMBL1406736

CCOC(=O)C(CCCC(=O)O)(C(C)=O)C(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.42
PKM P14618 1/20 0.42
HTT P42858 1/20 0.41
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
AKR1B1 P15121 1/20 0.38
GPR84 Q9NQS5 7/20 0.36
PPARG P37231 7/20 0.36
PPARD Q03181 7/20 0.36
PPARA Q07869 7/20 0.36
HDAC11 Q96DB2 5/20 0.36
TSHR P16473 4/20 0.36
PTPN1 P18031 3/20 0.36
ALDH1A1 P00352 2/20 0.36
TLR2 O60603 2/20 0.36

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
SCHEMBL28753773 0.93 THRB (0.40) THRBPKMHTTCYP4F2CYP4A11
SCHEMBL10068075 0.81 CYP4F2 (0.41) THRBPKMHTTCYP4F2CYP4A11
SCHEMBL1406347 0.80 TSHR (0.42) THRBPKMHTTCYP4F2CYP4A11
SCHEMBL1406411 0.78 CYP1A2 (0.42) THRBPKMHTTCYP4F2CYP4A11
SCHEMBL4100780 0.78 CYP4F2 (0.62) THRBPKMHTTCYP4F2CYP4A11
SCHEMBL27803622 0.77 CYP1A2 (0.47) THRBPKMHTTCYP4F2CYP4A11
SCHEMBL3925193 0.77 LMNA (0.43) KMT2AMAPTMEN1AKR1B1GPR84
SCHEMBL27544348 0.76 CYP4F2 (0.66) THRBPKMHTTCYP4F2CYP4A11
SCHEMBL28229150 0.76 CYP4F2 (0.40) THRBPKMHTTCYP4F2CYP4A11
SCHEMBL8747245 0.75 LMNA (0.34) KMT2AMAPTMEN1AKR1B1GPR84

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 3 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