SCHEMBL7324433

SCHEMBL7324433

CCOC(=O)C(CCc1ccc(Cl)cc1)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.84

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACE P12821 13/20 0.84
LMNA P02545 2/20 0.84
SMN1; SMN2 Q16637 1/20 0.77
ABCB11 O95342 2/20 0.59
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
USP2 O75604 1/20 0.57
CYP3A4 P08684 1/20 0.57
ALOX15 P16050 1/20 0.57
PDE3A Q14432 1/20 0.54

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
Enalapril SCHEMBL28322902 0.91 ACE (1.00) ACELMNASMN1; SMN2ABCB11MEN1
Enalapril SCHEMBL8089096 0.91 ACE (1.00) ACELMNASMN1; SMN2ABCB11MEN1
Enalapril SCHEMBL13933092 0.91 ACE (1.00) ACELMNASMN1; SMN2ABCB11MEN1
Enalapril SCHEMBL13575793 0.91 ACE (1.00) ACELMNASMN1; SMN2ABCB11MEN1
Enalapril SCHEMBL97 0.91 ACE (1.00) ACELMNASMN1; SMN2ABCB11MEN1
Enalapril SCHEMBL6159149 0.91 ACE (1.00) ACELMNASMN1; SMN2ABCB11MEN1
Enalapril SCHEMBL18 0.91 ACE (1.00) ACELMNASMN1; SMN2ABCB11MEN1
Enalapril SCHEMBL474012 0.91 ACE (1.00) ACELMNASMN1; SMN2ABCB11MEN1
Enalapril SCHEMBL8433334 0.91 ACE (1.00) ACELMNASMN1; SMN2ABCB11MEN1
Enalapril SCHEMBL678442 0.91 ACE (1.00) ACELMNASMN1; SMN2ABCB11MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4472380-A CARBOXYALKYL DIPEPTIDE DERIVATIVES MERCK & CO., INC. (US) 1984-09-18 US disclosed
US-4374829-A Aminoacid derivatives as antihypertensives MERCK & CO., INC. (US) 1983-02-22 US disclosed
EP-0012401-A1 Carboxyalkyl dipeptide derivatives, process for preparing them and pharmaceutical composition containing them MERCK & CO. INC. (US) 1980-06-25 EP disclosed