SCHEMBL28519182

SCHEMBL28519182

CCOC(=O)CC(=O)C(OCC)(OCC)OCC.[Zr]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.56
MGAM O43451 1/20 0.56
SI P14410 1/20 0.56
MGAM2 Q2M2H8 1/20 0.56
ALDH1A1 P00352 4/20 0.41
TRPA1 O75762 1/20 0.41
CYP1A2 P05177 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALOX15 P16050 2/20 0.34
SOAT1 P35610 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
PPID Q08752 1/20 0.33
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA12 O43570 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
SCHEMBL28528269 0.96 GAA (0.56) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28907063 0.85 MGAM (0.41) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28842806 0.83 GAA (0.47) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28520853 0.81 MGAM (0.41) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28513604 0.80 CYP2D6 (0.33) GAAMGAMSIMGAM2CYP1A2
SCHEMBL30534799 0.78 MGAM (0.37) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL30534810 0.77 TDP1 (0.38) GAAMGAMSIMGAM2SOAT1
Malonic Acid Diethyl Ester SCHEMBL28048904 0.77 GAA (0.94) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL21957630 0.76 MGAM (0.39) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL66328 0.76 GAA (0.64) GAAMGAMSIMGAM2ALDH1A1

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-107431096-B Rectifier element, method for manufacturing the same, and wireless communication device 东丽株式会社 2021-01-15 CN disclosed