SCHEMBL17482385

SCHEMBL17482385

CC(=O)OCCOCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
TSHR P16473 3/20 0.46
HTT P42858 1/20 0.35
CHRM5 P08912 3/20 0.33
CHRM1 P11229 3/20 0.33
TP53 P04637 2/20 0.33
HIF1A Q16665 2/20 0.33
CHRM3 P20309 2/20 0.33
HSD17B10 Q99714 2/20 0.33
PGR P06401 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
HTR1A P08908 1/20 0.33
CHRNB2 P17787 1/20 0.33
TBXA2R P21731 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33
CHRNA4 P43681 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL17916202 1.00 ALDH1A1 (0.46) ALDH1A1TSHRHTTCHRM5CHRM1
SCHEMBL9913179 0.94 ALDH1A1 (0.41) ALDH1A1TSHRHTTCHRM5CHRM1
SCHEMBL14189476 0.92 ALDH1A1 (0.44) ALDH1A1TSHRHTTHSD17B10THRB
SCHEMBL16756242 0.89 ALDH1A1 (0.48) ALDH1A1TSHRHTTCHRM5CHRM1
SCHEMBL2369417 0.84 THRB (0.51) ALDH1A1TSHRHTTTP53HIF1A
SCHEMBL12396077 0.84 THRB (0.51) ALDH1A1TSHRHTTTP53HIF1A
SCHEMBL12396078 0.84 THRB (0.51) ALDH1A1TSHRHTTTP53HIF1A
SCHEMBL17477825 0.84 ALDH1A1 (0.47) ALDH1A1TSHRHTTCHRM5CHRM1
SCHEMBL13006674 0.83 USP2 (0.38) ALDH1A1TSHR
SCHEMBL1104613 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170119485-A1 LEAK RESISTANT ARTICLE Ansell Limited (AU) 2017-05-04 US disclosed
US-20170119485-A1 LEAK RESISTANT ARTICLE Ansell Limited (AU) 2017-05-04 US disclosed
US-20160033418-A1 COMBINATION GLOVE FOR DETECTING BREACH OF HYDROPHILIC FLUID Ansell Limited (AU) 2016-02-04 US disclosed
US-20160033418-A1 COMBINATION GLOVE FOR DETECTING BREACH OF HYDROPHILIC FLUID Ansell Limited (AU) 2016-02-04 US disclosed