Ether

Ether

SCHEMBL15876153

CCCOCCOC(C)=O.CCOCC.OCCO

nearest known ligand 0.67

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.67
TSHR P16473 3/20 0.67
THRB P10828 2/20 0.44
LMNA P02545 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CHRM5 P08912 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36
PGR P06401 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
HTR1A P08908 1/20 0.36
CHRNB2 P17787 1/20 0.36
TBXA2R P21731 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CHRNA10 Q9GZZ6 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
SCHEMBL15876156 0.91 ALDH1A1 (0.70) ALDH1A1TSHRTHRBLMNAHSD17B10
Acetic Acid Propyl Ester SCHEMBL133511 0.90 ALDH1A1 (0.61) ALDH1A1TSHRTHRBLMNAHSD17B10
Ether SCHEMBL15348648 0.90 ALDH1A1 (0.74) ALDH1A1TSHRTHRBLMNAHSD17B10
Ether SCHEMBL151166 0.90 ALDH1A1 (0.74) ALDH1A1TSHRTHRBLMNAHSD17B10
SCHEMBL15876154 0.89 ALDH1A1 (0.67) ALDH1A1TSHRTHRBLMNAHSD17B10
Tetraethylene Glycol SCHEMBL20210845 0.89 ALDH1A1 (0.61) ALDH1A1TSHRTHRBLMNAHSD17B10
Triethylene Glycol SCHEMBL273637 0.89 ALDH1A1 (0.61) ALDH1A1TSHRTHRBLMNAHSD17B10
Ether SCHEMBL1401416 0.88 ALDH1A1 (0.72) ALDH1A1TSHRTHRBLMNAHSD17B10
Ether SCHEMBL243266 0.88 ALDH1A1 (0.72) ALDH1A1TSHRTHRBLMNAHSD17B10
SCHEMBL1401687 0.88 ALDH1A1 (0.59) ALDH1A1TSHRTHRBLMNAHSD17B10

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
EP-2757134-A2 Antireflective coating compositions and methods for depositing such coatings YAZAKI CORPORATION (JP) 2014-07-23 EP disclosed