SCHEMBL7345119

SCHEMBL7345119

CN(C(=O)OC(C)(C)C)C(=O)[C@@](C)(N)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
PAX8 Q06710 1/20 0.31

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
SCHEMBL4449246 0.82 HDAC6 (0.33) HDAC1HDAC2HDAC6PAX8
SCHEMBL8737769 0.76 HDAC6 (0.39) HDAC1HDAC2HDAC6PAX8
SCHEMBL9873641 0.74 HDAC6 (0.36) HDAC1HDAC2HDAC6
SCHEMBL3126231 0.73 DGAT1 (0.38) HDAC1HDAC2HDAC6
SCHEMBL159422 0.72 HDAC6 (0.33) HDAC1HDAC2HDAC6
SCHEMBL159423 0.72 HDAC6 (0.33) HDAC1HDAC2HDAC6
SCHEMBL432112 0.72 HDAC6 (0.37) HDAC1HDAC2HDAC6
SCHEMBL28676568 0.70 HDAC6 (0.36) HDAC1HDAC2HDAC6
SCHEMBL1486198 0.70 DGAT1 (0.44)
SCHEMBL8098483 0.70 HDAC6 (0.40) HDAC1HDAC2HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0431520-B1 Heterocyclic acyl aminodiol beta-amino acid derivatives SEARLE & CO (US) 1995-02-08 EP disclosed
US-5290787-A Renin inhibitors; hypotensive agents G. D. SEARLE & CO. (US) 1994-03-01 US disclosed
US-5283250-A Renin inhibitor;hypotensive agent G. D. SEARLE & CO. (US) 1994-02-01 US disclosed
US-5231111-A Imidazolyl/imidazolylalkyl-N-terminal cycloalkoxy-C-terminal amino hydroxy β-amino acid derivatives G. D. SEARLE & CO. (US) 1993-07-27 US disclosed
US-5223532-A Chromonyl/chromonylalkyl-N-terminal cycloalkoxy-C-terminal amino hydroxy β-amino derivatives G. D. SEARLE & CO. (US) 1993-06-29 US disclosed
US-5223512-A Renin inhibitors, hypotensive agents G. D. SEARLE & CO. (US) 1993-06-29 US disclosed
US-5223514-A Renin inhibiros, hypotensive agents G. D. SEARLE & CO. (US) 1993-06-29 US disclosed
US-5223534-A Renin inhibitors, hypotensive agents G. D. SEARLE & CO. (US) 1993-06-29 US disclosed
US-5217991-A Renin inhibitors for treating hypertension G. D. SEARLE & CO. (US) 1993-06-08 US disclosed
US-5217989-A Benothiophenyl/benzothiophenylalkyl-N-terminal cycloalkoxy-C-terminal amino hydroxy β-amino acid derivatives G. D. SEARLE & CO. (US) 1993-06-08 US disclosed
US-5212174-A Renin inhibitors for hypotensive agents G. D. SEARLE & CO. (US) 1993-05-18 US disclosed
US-5212175-A Benzothiophenyl benzothiophenylalkyl-N-terminal amino hydroxy β-amino acid derivatives G. D. SEARLE & CO. (US) 1993-05-18 US disclosed
US-5210095-A Renin inhibiting compound for treatment of hypertension G. D. SEARLE & CO. (US) 1993-05-11 US disclosed
US-5180725-A Renin inhibitors G. D. SEARLE & CO. (US) 1993-01-19 US disclosed
US-5180744-A Renin inhibitors; hypotensive agents G. D. SEARLE & CO. (US) 1993-01-19 US disclosed
US-5179102-A Naphthyridinyl/naphthyridinylalkyl-n-terminal anino hydroxy β-amino acid derivatives G. D. SEARLE & CO. (US) 1993-01-12 US disclosed
US-5175170-A Renin inhibitors, hypotensive agents G. D. SEARLE & CO. (US) 1992-12-29 US disclosed
US-5175181-A Renin inhibitors, hypotensive agents G. D. SEARLE & CO. (US) 1992-12-29 US disclosed
US-5171751-A Renin inhibitors, hypotensive agents G. D. SEARLE & CO. (US) 1992-12-15 US disclosed
US-5147888-A Hypotensive agents; renin inhibitors G. D. SEARLE & CO. (US) 1992-09-15 US disclosed