Ethyl Acetate

Ethyl Acetate

SCHEMBL4641708

CCOC(=O)CC(C)=O.CCOC(C)=O

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.67
LMNA P02545 1/20 0.67
HSD17B10 Q99714 1/20 0.67
GAA P10253 3/20 0.64
MGAM O43451 2/20 0.64
SI P14410 2/20 0.64
MGAM2 Q2M2H8 2/20 0.64
TRPA1 O75762 1/20 0.46
TSHR P16473 2/20 0.43
CYP1A2 P05177 1/20 0.40
ALOX15 P16050 2/20 0.39
SOAT1 P35610 1/20 0.39
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL1331782 0.93
SCHEMBL1331371 0.93
SCHEMBL1331762 0.93
SCHEMBL1332259 0.93
SCHEMBL15500 0.93
SCHEMBL1871576 0.93 GAA (0.74) ALDH1A1LMNAHSD17B10GAAMGAM
SCHEMBL1330988 0.93
SCHEMBL1330478 0.93
SCHEMBL25316429 0.90 GAA (0.70) ALDH1A1LMNAHSD17B10GAAMGAM
SCHEMBL1470037 0.90 GAA (0.70) ALDH1A1LMNAHSD17B10GAAMGAM

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4061915-A1 HOME CARE PRODUCT OR FORMULATION Symrise AG (DE) 2022-09-28 EP claimed
WO-2021098950-A1 HOME CARE PRODUCT OR FORMULATION SYMRISE AG (DE) 2021-05-27 WO claimed
EP-1954796-A1 IMPROVEMENTS RELATING TO FABRIC TREATMENT COMPOSITIONS UNILEVER PLC (GB) 2008-08-13 EP disclosed
WO-2007062833-A1 IMPROVEMENTS RELATING TO FABRIC TREATMENT COMPOSITIONS UNILEVER PLC (GB) 2007-06-07 WO disclosed
US-4568538-A Flavoring with norbornyl pyridine derivatives INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1986-02-04 US disclosed
EP-0154844-A1 Norbornyl pyridine derivatives, their production and compositions comprising them INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-09-18 EP disclosed