Ethyl Acetate

Ethyl Acetate

SCHEMBL5862364

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

nearest known ligand 0.74

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.74
LMNA P02545 1/20 0.74
HSD17B10 Q99714 1/20 0.74
TSHR P16473 2/20 0.46
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALOX15 P16050 1/20 0.42
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
SOAT1 P35610 1/20 0.42
CYP2C9 P11712 1/20 0.39
TRPA1 O75762 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
GLO1 Q04760 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CA12 O43570 1/20 0.36
CA1 P00915 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
Ethyl Acetate SCHEMBL2336202 1.00 ALDH1A1 (0.74) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Acetate SCHEMBL2764170 1.00 ALDH1A1 (0.74) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Acetate SCHEMBL390477 1.00
Ethyl Acetate SCHEMBL10517706 0.97 ALDH1A1 (0.70) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Acetate SCHEMBL4048106 0.97 ALDH1A1 (0.70) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Acetate SCHEMBL2010629 0.97 ALDH1A1 (0.70) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Acetate SCHEMBL5502461 0.97 ALDH1A1 (0.70) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Acetate SCHEMBL9131985 0.95 ALDH1A1 (0.67) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Acetate SCHEMBL7382473 0.95 ALDH1A1 (0.67) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Acetate SCHEMBL29038936 0.95 ALDH1A1 (0.67) ALDH1A1LMNAHSD17B10TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7074539-B2 Organic photoreceptor and image forming method KONICA CORPORATION (JP) 2006-07-11 US disclosed
US-6919155-B2 Organic photoreceptor and image forming method KONICA CORPORATION (JP) 2005-07-19 US disclosed
US-20050037273-A1 Organic photoreceptor and image forming method SHIBATA TOYOKO (JP) 2005-02-17 US disclosed
US-20030186146-A1 Organic photoreceptor and image forming method KONICA CORPORATION (JP) 2003-10-02 US disclosed