Ethyl Acetate

Ethyl Acetate

SCHEMBL28096321

CCCC(C)C(=O)OCC.CCOC(C)=O

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
LMNA P02545 1/20 0.58
HSD17B10 Q99714 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP2C19 P33261 2/20 0.37
POLB P06746 1/20 0.37
CYP3A4 P08684 1/20 0.37
GAA P10253 2/20 0.36
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
ALOX15 P16050 2/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
SOAT1 P35610 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL8245481 0.91 SMN1; SMN2 (0.45) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1
SCHEMBL13483255 0.91 SMN1; SMN2 (0.45) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1
SCHEMBL113543 0.91 SMN1; SMN2 (0.45) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1
Phosphine SCHEMBL27449508 0.89 SMN1; SMN2 (0.44) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1
SCHEMBL28227396 0.89 SMN1; SMN2 (0.44) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL18669389 0.89 SMN1; SMN2 (0.44) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1
SCHEMBL28254365 0.87 SMN1; SMN2 (0.43) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1
SCHEMBL30074139 0.85 SMN1; SMN2 (0.42) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1
SCHEMBL10900153 0.83 ALDH1A1 (0.52) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1
SCHEMBL29411185 0.83 SMN1; SMN2 (0.41) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1

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-105899651-A Benefit agent containing delivery particle based on styrene maleic anhydride copolymer 宝洁公司 2016-08-24 CN disclosed