Ethyl 3-Phenylpropanoate

Ethyl 3-Phenylpropanoate

SCHEMBL3322728

CCOC(=O)CCc1ccccc1.OBO

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.70
CYP4A11 Q02928 2/20 0.70
TDP1 Q9NUW8 1/20 0.68
L3MBTL1 Q9Y468 1/20 0.57
ALOX5 P09917 2/20 0.57
ABCB1 P08183 1/20 0.56
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.51
CYP4Z1 Q86W10 1/20 0.51
TRPV1 Q8NER1 1/20 0.50
APP P05067 1/20 0.50

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 3-Phenylpropanoate SCHEMBL304816 0.95 TDP1 (0.75) CYP4F2CYP4A11TDP1L3MBTL1ALOX5
Ethyl 3-Phenylpropanoate SCHEMBL7440447 0.93 TDP1 (0.72) CYP4F2CYP4A11TDP1L3MBTL1ALOX5
Ethyl 3-Phenylpropanoate SCHEMBL28983325 0.90 TDP1 (0.68) CYP4F2CYP4A11TDP1L3MBTL1ALOX5
Ethyl 3-Phenylpropanoate SCHEMBL311047 0.90 TDP1 (0.68) CYP4F2CYP4A11TDP1L3MBTL1ALOX5
Ethyl 3-Phenylpropanoate SCHEMBL27762292 0.90 TDP1 (0.68) CYP4F2CYP4A11TDP1L3MBTL1ALOX5
Ethyl 3-Phenylpropanoate SCHEMBL8614481 0.88 TDP1 (0.66) CYP4F2CYP4A11TDP1L3MBTL1ALOX5
Ethyl 3-Phenylpropanoate SCHEMBL6847259 0.88 TDP1 (0.66) CYP4F2CYP4A11TDP1L3MBTL1ALOX5
SCHEMBL9858129 0.88 TDP1 (0.66) CYP4F2CYP4A11TDP1L3MBTL1ALOX5
SCHEMBL2773061 0.88 CYP4F2 (0.68) CYP4F2CYP4A11TDP1ALOX5ABCB1
Ethyl 3-Phenylpropanoate SCHEMBL27562389 0.87 CYP4F2 (0.66) CYP4F2CYP4A11TDP1L3MBTL1ALOX5

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
EP-2155717-B1 2-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-3-PHENYL PYRAZINES AND PYRIDINES AND 3-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-2-PHENYL PYRIDINES AS 5-HT7 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2012-10-24 EP disclosed
US-20100120785-A1 2-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-3-PHENYL PYRAZINES AND PYRIDINES AND 3-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-2-PHENYL PYRIDINES AS 5-HT7 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2010-05-13 US disclosed
EP-2155717-A1 2-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-3-PHENYL PYRAZINES AND PYRIDINES AND 3-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-2-PHENYL PYRIDINES AS 5-HT7 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2010-02-24 EP disclosed
WO-2008141020-A1 2-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-3-PHENYL PYRAZINES AND PYRIDINES AND 3-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-2-PHENYL PYRIDINES AS 5-HT7 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2008-11-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100120785-A1 2-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-3-PHENYL PYRAZINES AND PYRIDINES AND 3-[4-(PYRAZOL-4-YLALKYL)PIPERAZIN-1-YL]-2-PHENYL PYRIDINES AS 5-HT7 RECEPTOR ANTAGONISTS HTR7, HTR2C, HTR4 CYP4F2 1513/4885CYP4A11 756/4885TDP1 4155/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.