SCHEMBL10657581

SCHEMBL10657581

C[C@@H](C(=O)N1CCC[C@H]1C(=O)O)N(CC(=O)OC(C)(C)C)C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 10/20 0.47
▸ LMNA P02545 1/20 0.46
▸ CMA1 P23946 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ FKBP1A P62942 1/20 0.42
▸ PREP P48147 1/20 0.42
▸ LTA4H P09960 1/20 0.42

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
SCHEMBL10662817 0.89 ACE (0.46) ACELMNASMN1; SMN2FKBP1APREP
SCHEMBL10657952 0.89 ACE (0.54) ACELMNASMN1; SMN2PREPLTA4H
SCHEMBL10655550 0.89 ACE (0.52) ACELMNASMN1; SMN2PREPLTA4H
SCHEMBL10658161 0.89 ACE (0.52) ACELMNASMN1; SMN2PREPLTA4H
SCHEMBL10662821 0.89 ACE (0.45) ACELMNASMN1; SMN2FKBP1APREP
SCHEMBL10785790 0.85 ACE (0.64) ACECMA1
SCHEMBL10785793 0.85 ACE (0.64) ACECMA1
SCHEMBL28551091 0.83 ACE (0.54) ACELMNACMA1SMN1; SMN2LTA4H
SCHEMBL10660541 0.81 ACE (0.54) ACELMNASMN1; SMN2PREPLTA4H
SCHEMBL7368526 0.81 ACE (0.51) ACELMNACMA1LTA4H

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-4736066-A Intermediate for substituted peptide compounds E. R. SQUIBB & SONS, INC. (US) 1988-04-05 — — US disclosed
US-4535176-A HYPOTENSIVE AGENTS, ANALGESICS, ANGIOTENSIN CONVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1985-08-13 — — US disclosed
US-4470973-A HYPOTENSIVE AGENTS, ANALGESICS E. R. SQUIBB & SONS, INC. (US) 1984-09-11 — — US disclosed
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