Ethyl Benzoate

Ethyl Benzoate

SCHEMBL677239

CCOC(=O)c1ccccc1.COC(=O)c1ccccc1

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.73
SMN1; SMN2 Q16637 6/20 0.66
RAB9A P51151 5/20 0.66
NPC1 O15118 3/20 0.66
GAA P10253 1/20 0.66
LMNA P02545 2/20 0.61
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
ALDH1A1 P00352 2/20 0.59
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
ESR1 P03372 1/20 0.58
CA7 P43166 1/20 0.58
CA9 Q16790 1/20 0.58
ESR2 Q92731 1/20 0.58
CA14 Q9ULX7 1/20 0.58
MAPK1 P28482 2/20 0.57
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56

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 Benzoate SCHEMBL55674 0.92 LMNA (0.70) TSHRSMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL25388294 0.92 LMNA (0.70) TSHRSMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL2762273 0.92 LMNA (0.70) TSHRSMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL950673 0.90 SMN1; SMN2 (0.68) TSHRSMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL28365249 0.90 LMNA (0.68) TSHRSMN1; SMN2RAB9ANPC1GAA
SCHEMBL4444431 0.90 CA1 (0.70) TSHRSMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL28871046 0.90 LMNA (0.68) TSHRSMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL10340677 0.90 LMNA (0.68) TSHRSMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL595705 0.90 LMNA (0.68) TSHRSMN1; SMN2RAB9ANPC1GAA
Ethyl Benzoate SCHEMBL29554608 0.90 LMNA (0.68) TSHRSMN1; SMN2RAB9ANPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9978473-B2 Doping methods for hole injection and transport layers NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-05-22 US disclosed
EP-2764518-A1 IMPROVED DOPING METHODS FOR HOLE INJECTION AND TRANSPORT LAYERS Plextronics, Inc. (US) 2014-08-13 EP disclosed
US-20140217334-A1 DOPING CONJUGATED POLYMERS AND DEVICES PLEXTRONICS, INC. (US) 2014-08-07 US disclosed
US-8674047-B2 Doping conjugated polymers and devices PLEXTRONICS, INC. (US) 2014-03-18 US disclosed
US-20130092887-A1 Doping methods for hole injection and transport layers PLEXTRONICS, INC. (US) 2013-04-18 US disclosed
WO-2013052096-A1 IMPROVED DOPING METHODS FOR HOLE INJECTION AND TRANSPORT LAYERS PLEXTRONICS, INC. (US) 2013-04-11 WO disclosed
EP-2569347-A1 DOPING CONJUGATED POLYMERS AND DEVICES Plextronics, Inc. (US) 2013-03-20 EP disclosed
US-20110278559-A1 DOPING CONJUGATED POLYMERS AND DEVICES PLEXTRONICS, INC. 2011-11-17 US disclosed
WO-2011143196-A1 DOPING CONJUGATED POLYMERS AND DEVICES PLEXTRONICS, INC. (US) 2011-11-17 WO disclosed
EP-0309140-A1 Catalytic component for olefin polymerization Tonen Corporation (JP) 1989-03-29 EP disclosed