SCHEMBL10663965

SCHEMBL10663965

NCCCCN(CC(=O)C(Cc1ccccc1)NC(=O)c1ccccc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 18/20 0.64
▸ ACE2 Q9BYF1 11/20 0.64

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
SCHEMBL10671844 0.86 ACE (0.57) ACEACE2
SCHEMBL10847107 0.86 ACE (0.72) ACEACE2
SCHEMBL10664899 0.86 ACE (0.72) ACEACE2
SCHEMBL10847172 0.85 ACE (0.51) ACEACE2
SCHEMBL10664993 0.82 ACE (0.73) ACEACE2
SCHEMBL10663756 0.81 ACE (0.54) ACEACE2
SCHEMBL7360576 0.81 ACE (0.74) ACEACE2
SCHEMBL7360582 0.81 ACE (0.74) ACEACE2
SCHEMBL10669883 0.81 ACE (0.71) ACEACE2
Hydrochloric Acid SCHEMBL9536922 0.80 ACE (0.73) ACEACE2

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-4742067-A Acylalkylaminocarbonyl substituted amino and imino acid compounds E. R. SQUIBB & SONS, INC. (US) 1988-05-03 — — US disclosed
US-4621092-A HYPOTENSIVE, ANALGESIC E. R. SQUIBB & SONS, INC. (US) 1986-11-04 — — US disclosed
EP-0103496-A1 Acylalkylaminocarbonyl substituted amino and imino acid compounds E.R. Squibb & Sons, Inc. (US) 1984-03-21 — — EP disclosed
Send feedback