SCHEMBL2739907

SCHEMBL2739907

C=C(C)C(=O)OCCOC(=O)C1CCCCC1C(=O)OC1CCCCO1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
THRB P10828 1/20 0.38
TSHR P16473 3/20 0.37
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
HTT P42858 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL208911 0.83 THRB (0.52) ALDH1A1TP53CYP3A4THRBTSHR
SCHEMBL9480448 0.82 ALDH1A1 (0.44) ALDH1A1TP53CYP3A4THRBTSHR
SCHEMBL422110 0.80 TSHR (0.56) ALDH1A1TP53CYP3A4THRBTSHR
SCHEMBL20664393 0.80 TSHR (0.43) ALDH1A1THRBTSHRMEN1KMT2A
SCHEMBL18436477 0.80 TSHR (0.43) ALDH1A1THRBTSHRMEN1KMT2A
SCHEMBL219412 0.79 ALDH1A1 (0.40) ALDH1A1TSHRMEN1KMT2A
SCHEMBL2735091 0.79 ALDH1A1 (0.43) ALDH1A1TP53CYP3A4THRBTSHR
SCHEMBL2706243 0.79 ALDH1A1 (0.38) ALDH1A1THRBTSHRMEN1KMT2A
SCHEMBL8680879 0.78 ALDH1A1 (0.45) ALDH1A1THRBTSHRMEN1KMT2A
SCHEMBL14473517 0.78 THRB (0.46) ALDH1A1TP53CYP3A4THRBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114949-B2 (Meth)acrylate, polymer and resist composition MITSUBISHI RAYON CO., LTD. (JP) 2012-02-14 US disclosed
US-8114949-B2 (Meth)acrylate, polymer and resist composition MITSUBISHI RAYON CO., LTD. (JP) 2012-02-14 US disclosed
US-8088875-B2 (Meth)acrylate, polymer and resist composition MITSUBISHI RAYON CO., LTD. (JP) 2012-01-03 US disclosed
US-8088875-B2 (Meth)acrylate, polymer and resist composition MITSUBISHI RAYON CO., LTD. (JP) 2012-01-03 US disclosed
US-20090226851-A1 (METH)ACRYLATE, POLYMER AND RESIST COMPOSITION MITSUBISHI RAYON CO., LTD. (JP) 2009-09-10 US disclosed
US-20090226851-A1 (METH)ACRYLATE, POLYMER AND RESIST COMPOSITION MITSUBISHI RAYON CO., LTD. (JP) 2009-09-10 US disclosed
US-20080003529-A1 (Meth)Acrylate, Polymer and Resist Composition MITSUBISHI RAYON CO., LTD. (JP) 2008-01-03 US disclosed
US-20080003529-A1 (Meth)Acrylate, Polymer and Resist Composition MITSUBISHI RAYON CO., LTD. (JP) 2008-01-03 US disclosed