Ethyl Caffeate

Ethyl Caffeate

SCHEMBL27648151

CCOC(=O)C=Cc1ccc(O)c(O)c1.Oc1ccccc1O

nearest known ligand 0.91

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 5/20 0.91
DPP4 P27487 1/20 0.91
APP P05067 12/20 0.72
AKR1B10 O60218 2/20 0.68
AKR1B1 P15121 2/20 0.68
MAOB P27338 1/20 0.68
CYP3A4 P08684 3/20 0.68
ALOX15 P16050 2/20 0.65
ALOX12 P18054 2/20 0.65
MAPK1 P28482 2/20 0.65
HSD17B10 Q99714 2/20 0.65
KDM4E B2RXH2 1/20 0.65
MEN1 O00255 1/20 0.65
GMNN O75496 1/20 0.65
ALDH1A1 P00352 1/20 0.65
EGFR P00533 1/20 0.65
LMNA P02545 1/20 0.65
ESR1 P03372 1/20 0.65
ERBB2 P04626 1/20 0.65
LCK P06239 1/20 0.65

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 Caffeate SCHEMBL28088236 0.95 TTR (0.94) TTRDPP4APPAKR1B10AKR1B1
Ethyl Caffeate SCHEMBL30602576 0.95 TTR (1.00) TTRDPP4APPAKR1B10AKR1B1
Ethyl Caffeate SCHEMBL30286241 0.95 TTR (1.00) TTRDPP4APPAKR1B10AKR1B1
Ethyl Caffeate SCHEMBL782032 0.95 TTR (1.00) TTRDPP4APPAKR1B10AKR1B1
Ethyl Caffeate SCHEMBL782033 0.95 TTR (1.00) TTRDPP4APPAKR1B10AKR1B1
Ethyl Caffeate SCHEMBL31059266 0.95 TTR (1.00) TTRDPP4APPAKR1B10AKR1B1
Ethyl Caffeate SCHEMBL22196845 0.95 TTR (1.00) TTRDPP4APPAKR1B10AKR1B1
SCHEMBL4262076 0.93 TTR (0.94) TTRDPP4APPAKR1B10AKR1B1
SCHEMBL4262080 0.93 TTR (0.94) TTRDPP4APPAKR1B10AKR1B1
Ethyl Caffeate SCHEMBL28516367 0.91 TTR (0.91) TTRDPP4APPAKR1B10AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108992434-A Application of caffeic acid 3, 4-dihydroxy phenethyl ester in preparation of medicine for preventing colorectal cancer 浙江大学 2018-12-14 CN claimed
CN-101502506-A Medical use of 3-(3,4-dihydroxyphenyl)-acrylic acid 2-(3,4-dihydroxyphenyl)-ethyl ester XIAOYUAN LIAN (CN) 2009-08-12 CN claimed
CN-1879672-A Medicine containing effective components of sarcandra glabra, preparation method and application thereof LIAN XIAOYUAN (CN) 2006-12-20 CN claimed
CN-108992434-A Application of caffeic acid 3, 4-dihydroxy phenethyl ester in preparation of medicine for preventing colorectal cancer 浙江大学 2018-12-14 CN disclosed
CN-108992434-A Application of caffeic acid 3, 4-dihydroxy phenethyl ester in preparation of medicine for preventing colorectal cancer 浙江大学 2018-12-14 CN disclosed
CN-108992434-A Application of caffeic acid 3, 4-dihydroxy phenethyl ester in preparation of medicine for preventing colorectal cancer 浙江大学 2018-12-14 CN disclosed
CN-102949384-A Application of coffee acid 3, 4-dihydroxy benzene ethyl ester to preparation of antitumor drug UNIV ZHEJIANG 2013-03-06 CN disclosed
CN-101502506-B Medical use of 3-(3,4-dihydroxyphenyl)-acrylic acid 2-(3,4-dihydroxyphenyl)-ethyl ester XIAOYUAN LIAN 2011-08-17 CN disclosed
CN-101543488-B A medicine containing caffeic acid 3,4-dihydroxyl phenethyl ester and its uses XIAOYUAN LIAN 2011-03-02 CN disclosed
CN-1879672-B Total polyphenol of effective parts of plant glabrous sarcandra herb as well as preparation method and application thereof XIAOYUAN LIAN 2010-06-16 CN disclosed
CN-101574381-A Extractive of effective part of chloranthus glaber and preparation method thereof JIANGZHONG PHARMACEUTICAL CO L (CN) 2009-11-11 CN disclosed
CN-101543488-A A medicine containing caffeic acid 3,4-dihydroxyl phenethyl ester and its uses XIAOYUAN LIAN 2009-09-30 CN disclosed
CN-101502506-A Medical use of 3-(3,4-dihydroxyphenyl)-acrylic acid 2-(3,4-dihydroxyphenyl)-ethyl ester XIAOYUAN LIAN (CN) 2009-08-12 CN disclosed
CN-1879672-A Medicine containing effective components of sarcandra glabra, preparation method and application thereof LIAN XIAOYUAN (CN) 2006-12-20 CN disclosed