SCHEMBL4969443

SCHEMBL4969443

C=C(C)C(=O)OCCOCCO.CCCCOCCCC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.61
TSHR P16473 7/20 0.59
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
HTT P42858 2/20 0.52
MAPT P10636 1/20 0.52
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 2/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP1 P29466 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SLCO1B3 Q9NPD5 1/20 0.40
SLCO1B1 Q9Y6L6 1/20 0.40
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
EPHX2 P34913 1/20 0.39
ACHE P22303 1/20 0.38

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
Butoxyethanol SCHEMBL28213660 0.95 TSHR (0.61) THRBTSHRMEN1KMT2AHTT
SCHEMBL4969152 0.94 TSHR (0.70) THRBTSHRMEN1KMT2AHTT
SCHEMBL4967751 0.93 TSHR (0.62) THRBTSHRMEN1KMT2AHTT
Di(Hydroxyethyl)Ether SCHEMBL5447225 0.93 TSHR (0.68) THRBTSHRMEN1KMT2AHTT
SCHEMBL36708 0.93 THRB (0.69) THRBTSHRMEN1KMT2AHTT
SCHEMBL887794 0.93 THRB (0.69) THRBTSHRMEN1KMT2AHTT
SCHEMBL320130 0.93 THRB (0.69) THRBTSHRMEN1KMT2AHTT
SCHEMBL34027 0.93 THRB (0.69) THRBTSHRMEN1KMT2AHTT
SCHEMBL6859246 0.93 THRB (0.69) THRBTSHRMEN1KMT2AHTT
SCHEMBL13317999 0.91 THRB (0.61) THRBTSHRMEN1KMT2AHTT

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-1249333-B9 Fiber-reinforced plastic molded article and method for its production DAINIPPON INK & CHEMICALS (JP) 2008-09-10 EP disclosed
EP-1249333-B1 Fiber-reinforced plastic molded article and method for its production DAINIPPON INK & CHEMICALS (JP) 2008-03-05 EP disclosed
US-6863973-B2 Fiber-reinforced plastic molded article, its production method and a molding mold using that method DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-03-08 US disclosed
US-20030035961-A1 Fiber-reinforced plastic molded article, its production method and a molding mold using that method DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-02-20 US disclosed
EP-1249333-A2 Fiber-reinforced plastic molded article and method for its production DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-10-16 EP disclosed