SCHEMBL3369452

SCHEMBL3369452

CCOC(=O)[C@@H](CCc1ccccc1)N[C@@H](C)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE P12821 11/20 0.60
LMNA P02545 2/20 0.60
ABCB11 O95342 2/20 0.58
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
USP2 O75604 1/20 0.56
CYP3A4 P08684 1/20 0.56
ALOX15 P16050 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
PDE3A Q14432 1/20 0.53
REN P00797 1/20 0.52

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
SCHEMBL4669890 1.00 ACE (0.60) ACELMNAABCB11MEN1KMT2A
SCHEMBL28866775 1.00 ACE (0.60) ACELMNAABCB11MEN1KMT2A
SCHEMBL4669888 1.00 ACE (0.60) ACELMNAABCB11MEN1KMT2A
SCHEMBL497515 1.00 ACE (0.60) ACELMNAABCB11MEN1KMT2A
SCHEMBL4669921 1.00 ACE (0.60) ACELMNAABCB11MEN1KMT2A
SCHEMBL3780597 1.00 ACE (0.60) ACELMNAABCB11MEN1KMT2A
SCHEMBL2897972 1.00 ACE (0.60) ACELMNAABCB11MEN1KMT2A
SCHEMBL1221172 1.00 ACE (0.60) ACELMNAABCB11MEN1KMT2A
Hydrochloric Acid SCHEMBL7264173 0.99 ACE (0.59) ACELMNAABCB11MEN1KMT2A
SCHEMBL11041388 0.99 ACE (0.59) ACELMNAABCB11MEN1KMT2A

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1679303-B1 Process for preparing 1-alkoxycarbonyl-3-phenylpropyl derivative KANEKA CORP (JP) 2010-09-15 EP claimed
EP-1284957-B1 PURIFICATION METHOD OF N-(1(S)-ETHOXYCARBONYL-3-PHENYLPROPYL)-L-ALANINE KANEKA CORP (JP) 2008-05-07 EP claimed
EP-1679303-A1 Process for preparing 1-alkoxycarbonyl-3-phenylpropyl derivative Kaneka Corporation (JP) 2006-07-12 EP claimed
US-7071349-B2 Purification method of N-(1(S)-ethoxycarbonyl-3-phenylpropyl)-L-alanine KANAKA CORPORATION (JP) 2006-07-04 US claimed
EP-0903337-B1 PROCESS FOR THE PREPARATION OF 1-ALKOXYCARBONYL-3-PHENYLPROPYL DERIVATIVES KANEKA CORP (JP) 2006-04-12 EP claimed
EP-1284957-A4 PURIFICATION METHOD OF N-(1(S)-ETHOXYCARBONYL-3-PHENYLPROPYL)-L-ALANINE KANEKA CORP (JP) 2004-12-29 EP claimed
US-20030162991-A1 Purification method of n-(1(s)-ethoxycarbonyl-3-phenylpropyl)-l-alanine KANEKA CORPORATION (JP) 2003-08-28 US claimed
EP-1284957-A1 PURIFICATION METHOD OF N-(1(S)-ETHOXYCARBONYL-3-PHENYLPROPYL)-L-ALANINE KANEKA CORPORATION (JP) 2003-02-26 EP claimed
WO-2002074728-A1 PURIFICATION METHOD OF N-(1(S)-ETHOXYCARBONYL-3-PHENYLPROPYL)-L-ALANINE KANEKA CORPORATION (JP) 2002-09-26 WO claimed
US-6118010-A CATALYTIC REDUCTION OF THE 1-ALKOXYCARBONYL-3-OXO-3-PHENYLPROPYL DERIVATIVE KANEKA CORPORATION (JP) 2000-09-12 US claimed
EP-0903337-A1 PROCESS FOR THE PREPARATION OF 1-ALKOXYCARBONYL-3-PHENYLPROPYL DERIVATIVES KANEKA CORPORATION (JP) 1999-03-24 EP claimed
EP-1679303-B1 Process for preparing 1-alkoxycarbonyl-3-phenylpropyl derivative KANEKA CORP (JP) 2010-09-15 EP disclosed
EP-1284957-B1 PURIFICATION METHOD OF N-(1(S)-ETHOXYCARBONYL-3-PHENYLPROPYL)-L-ALANINE KANEKA CORP (JP) 2008-05-07 EP disclosed
EP-1679303-A1 Process for preparing 1-alkoxycarbonyl-3-phenylpropyl derivative Kaneka Corporation (JP) 2006-07-12 EP disclosed
US-7071349-B2 Purification method of N-(1(S)-ethoxycarbonyl-3-phenylpropyl)-L-alanine KANAKA CORPORATION (JP) 2006-07-04 US disclosed
EP-0338508-A2 Esters from amino-acids, their preparation process, drugs containing same and their use HOECHST AKTIENGESELLSCHAFT (DE) 1989-10-25 EP disclosed
US-4808741-A Process for preparing carboxyalkyl dipeptides TORCAN CHEMICAL LTD. (CA) 1989-02-28 US disclosed
US-4652668-A Aromatic amino acid derivatives BIOMEASURE, INC. (US) 1987-03-24 US disclosed
EP-0104461-A2 Process for preparing antihypertensive 1-substituted cyclic lactam-2-carboxylic acids and their derivatives E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-04-04 EP disclosed
US-4439364-A Process for preparing antihypertensive 1-substituted cyclic lactam-2-carboxylic acids and their derivatives E. I. DU PONT DE NEMOURS & COMPANY (US) 1984-03-27 US 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-20030162991-A1 Purification method of n-(1(s)-ethoxycarbonyl-3-phenylpropyl)-l-alanine ANPEP, NPEPPS, ADH1A ACE 308/4885LMNA 268/4885ABCB11 423/4885

“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.