SCHEMBL21489550

SCHEMBL21489550

CC(O)CCOCCOCCO

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
TSHR P16473 4/20 0.50
MAPK1 P28482 1/20 0.50
THRB P10828 1/20 0.43
HTT P42858 1/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 2/20 0.36
HSD17B10 Q99714 1/20 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
SCHEMBL2587859 0.97
Triethylene Glycol SCHEMBL6745987 0.90 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
Di(Hydroxyethyl)Ether SCHEMBL7206342 0.87 TSHR (0.53) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL10881138 0.87 HSD17B10 (0.43) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL10891930 0.87 HSD17B10 (0.43) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL10887459 0.87 HSD17B10 (0.43) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL10885467 0.87 HSD17B10 (0.43) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL620600 0.87 HSD17B10 (0.43) MEN1KMT2ATSHRMAPK1ALDH1A1
Propylene Glycol SCHEMBL3359839 0.84 MEN1 (0.61) MEN1KMT2ATSHRMAPK1THRB
Propylene Glycol SCHEMBL8851056 0.84 MEN1 (0.61) MEN1KMT2ATSHRMAPK1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190322835-A1 METHODS OF RECYCLING AND RESHAPING THERMOSETTING POLYMERS AND COMPOSITES THEREOF GEORGIA TECH RESEARCH CORPORATION 2019-10-24 US disclosed