SCHEMBL18179722

SCHEMBL18179722

CCCC(=O)OCCOCCOCCOCCOC(=O)CCS

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.48
ALDH1A1 P00352 4/20 0.43
DNM1 Q05193 1/20 0.41
TSHR P16473 3/20 0.38
ADRA2A P08913 1/20 0.38
ADRA1A P35348 1/20 0.38
EPHX2 P34913 2/20 0.37
MAPT P10636 1/20 0.36
BLM P54132 1/20 0.36
HTR2C P28335 1/20 0.36
NAAA Q02083 1/20 0.35
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
TP53 P04637 2/20 0.33
HIF1A Q16665 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
THRB P10828 1/20 0.33
MGLL Q99685 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
SCHEMBL13398932 0.94 DGKA (0.54) DGKAALDH1A1DNM1ADRA2AADRA1A
SCHEMBL29601907 0.89 DGKA (0.58) DGKAALDH1A1DNM1TSHRADRA2A
SCHEMBL98157 0.89 DGKA (0.41) DGKAALDH1A1DNM1TSHRADRA2A
Triethylene Glycol Dibutanoate SCHEMBL4305344 0.89 DGKA (0.58) DGKAALDH1A1DNM1TSHRADRA2A
Diethylene Glycol Dibutanoate SCHEMBL421383 0.89 DGKA (0.58) DGKAALDH1A1DNM1TSHRADRA2A
SCHEMBL98263 0.89 DGKA (0.41) DGKAALDH1A1DNM1TSHRADRA2A
SCHEMBL13465983 0.89 DGKA (0.58) DGKAALDH1A1DNM1TSHRADRA2A
SCHEMBL98818 0.89 DGKA (0.41) DGKAALDH1A1DNM1TSHRADRA2A
SCHEMBL10577482 0.89 DGKA (0.55) DGKAALDH1A1DNM1TSHREPHX2
SCHEMBL18378681 0.88 NAAA (0.44) DGKAALDH1A1DNM1TSHRADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9957376-B2 Optical material composition and use thereof ETERNAL MATERIALS CO., LTD. (TW) 2018-05-01 US disclosed
US-20160312009-A1 OPTICAL MATERIAL COMPOSITION AND USE THEREOF ETERNAL MATERIALS CO., LTD. (TW) 2016-10-27 US disclosed