SCHEMBL28286104

SCHEMBL28286104

C=C(C(C)=O)C(=O)OCOC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
HSD17B10 Q99714 2/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 4/20 0.34
TDP1 Q9NUW8 1/20 0.33
THRB P10828 1/20 0.32
CHRM5 P08912 2/20 0.32
CHRM1 P11229 2/20 0.32
CHRM3 P20309 2/20 0.32
PGR P06401 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
HTR1A P08908 1/20 0.32
CHRNB2 P17787 1/20 0.32
TBXA2R P21731 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32
CHRNA4 P43681 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL6898581 0.82 ALDH1A1 (0.46) ALDH1A1HSD17B10LMNATSHRTDP1
SCHEMBL2625617 0.81 TSHR (0.52) ALDH1A1HSD17B10LMNATSHRTDP1
SCHEMBL2178036 0.80 ALDH1A1 (0.46) ALDH1A1HSD17B10LMNATSHRTDP1
SCHEMBL8240773 0.80
SCHEMBL9313077 0.80 ALDH1A1 (0.50) ALDH1A1HSD17B10LMNATSHRTDP1
SCHEMBL10944510 0.78 TSHR (0.50) ALDH1A1HSD17B10LMNATSHRTDP1
SCHEMBL21693942 0.78 ALDH1A1 (0.50) ALDH1A1HSD17B10LMNATSHRTDP1
SCHEMBL322669 0.77
SCHEMBL3137540 0.76 GLO1 (0.52) ALDH1A1HSD17B10LMNATSHRTHRB
SCHEMBL28063807 0.76 ALDH1A1 (0.42) ALDH1A1HSD17B10LMNATSHRTDP1

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
CN-109628023-A A kind of acryloid cement gold stamping for casement and preparation method thereof 桐乡市星邦科技发展有限公司 2019-04-16 CN disclosed