SCHEMBL5016575

SCHEMBL5016575

CC(=O)OSSOC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
TSHR P16473 4/20 0.44
LMNA P02545 4/20 0.36
HSD17B10 Q99714 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
GAA P10253 1/20 0.33
THPO P40225 1/20 0.33
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
CA1 P00915 1/20 0.31
ALOX15 P16050 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31

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
SCHEMBL1925081 0.77
SCHEMBL15372439 0.72
SCHEMBL28537195 0.69
Potassium Ion SCHEMBL29113878 0.69
SCHEMBL29710585 0.69
SCHEMBL10608630 0.67
SCHEMBL29050117 0.64
Hydrochloric Acid SCHEMBL28338965 0.64
Water SCHEMBL28846402 0.64
Acetone SCHEMBL8014937 0.63

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
CN-112457228-B Preparation method of thioglycollic acid-2-ethylhexyl ester in fused salt hydrate 山东沾化金嘉利化工科技有限公司 2022-07-29 CN disclosed
EP-1992308-A2 Intracorporeal occlusive device Microtransform, Inc. (US) 2008-11-19 EP disclosed