SCHEMBL28679682

SCHEMBL28679682

CCOC(=O)CC(O)(CC(=O)OC(=O)C(=O)O)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
TRPA1 O75762 1/20 0.35
SOAT1 P35610 1/20 0.33
HSD11B1 P28845 1/20 0.33
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
CYP1A2 P05177 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL1768041 0.88 ALDH1A1 (0.36) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL73474 0.87 ALDH1A1 (0.48) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL2118956 0.85 ALDH1A1 (0.46) ALDH1A1GAAMGAMSIMGAM2
Ammonia Solution, Strong SCHEMBL28679472 0.85 ALDH1A1 (0.46) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL28784375 0.85 ALDH1A1 (0.46) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL166758 0.84 ALDH1A1 (0.40) ALDH1A1GAAMGAMSIMGAM2
Hydroxyamine SCHEMBL27485358 0.83 ALDH1A1 (0.44) ALDH1A1GAAMGAMSIMGAM2
Citric Acid SCHEMBL4292973 0.82 ALDH1A1 (0.60) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL72953 0.82 ALDH1A1 (0.60) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL30384961 0.82 ALDH1A1 (0.60) ALDH1A1GAAMGAMSIMGAM2

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-107417819-B Solid catalyst component for olefin polymerization, catalyst and application thereof 北京利和知信科技有限公司 2021-11-16 CN disclosed
CN-109280112-B Catalyst composition suitable for propylene homopolymerization or copolymerization 任丘市利和科技发展有限公司 2021-06-08 CN disclosed