SCHEMBL19821817

SCHEMBL19821817

CCC(C)OC(=O)COC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
LMNA P02545 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TSHR P16473 3/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM1 P11229 1/20 0.36
TBXA2R P21731 1/20 0.36
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GALR3 O60755 1/20 0.35
BLM P54132 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
FAAH O00519 3/20 0.34
EPHX2 P34913 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32

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
SCHEMBL11454316 0.85 FAAH (0.44) ALDH1A1LMNAHSD17B10TSHRCHRM2
SCHEMBL26412892 0.85 ALDH1A1 (0.35) ALDH1A1LMNAHSD17B10TSHRCHRM2
SCHEMBL12922584 0.81 TSHR (0.48) ALDH1A1TSHRMAPTFAAHEPHX2
SCHEMBL7064365 0.80 TSHR (0.52) ALDH1A1LMNAHSD17B10TSHRCHRM2
SCHEMBL19821826 0.80 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10TSHRCHRM2
SCHEMBL11896926 0.80 TDP1 (0.36) ALDH1A1LMNAHSD17B10TSHRCHRM2
SCHEMBL19821869 0.78 EPHX2 (0.34) LMNATSHRCHRM2CHRM4CHRM1
SCHEMBL12922583 0.77 TSHR (0.48) ALDH1A1HSD17B10TSHRMAPTSMN1; SMN2
SCHEMBL19821816 0.77 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10TSHRMAPT
SCHEMBL26183 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773266-B2 Polymer, molded body, foam, resin composition, and production method for polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-03 US disclosed
US-20230129965-A1 HYDROPHILIC AND OLEOPHOBIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed
US-20180030175-A1 POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-01 US disclosed
CN-104529764-B A kind of method extracting sec-butyl acetate by-product heavy hydrocarbon 惠州宇新化工有限责任公司 2016-08-24 CN disclosed
CN-104529764-A Method for extracting sec-butyl acetate by-product heavy hydrocarbon HUIZHOU ZHONGCHUANG CHEMICAL CO LTD 2015-04-22 CN disclosed
CN-102875328-B Catalyzing rectifying technology for synthesizing sec-butyl alcohol through ester exchange method and production equipment of catalyzing rectifying technology UNIV FUZHOU 2014-05-21 CN disclosed
CN-102875328-A Catalyzing rectifying technology for synthesizing sec-butyl alcohol through ester exchange method and production equipment of catalyzing rectifying technology UNIV FUZHOU 2013-01-16 CN disclosed