SCHEMBL10847172

SCHEMBL10847172

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

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 16/20 0.51
▸ ACE2 Q9BYF1 10/20 0.51

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
SCHEMBL10846880 0.86 ACE (0.47) ACEACE2
SCHEMBL10846942 0.85 ACE (0.58) ACEACE2
SCHEMBL10663965 0.85 ACE (0.64) ACEACE2
SCHEMBL10844765 0.82 ACE (0.56) ACEACE2
SCHEMBL10844071 0.81 ACE (0.51) ACEACE2
SCHEMBL10849422 0.80 ACE (0.58) ACEACE2
SCHEMBL7361625 0.80 ACE (0.58) ACEACE2
SCHEMBL7445000 0.80 ACE (0.58) ACEACE2
SCHEMBL7361632 0.80 ACE (0.58) ACEACE2
SCHEMBL7361785 0.80 ACE (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4604402-A HYPOTENSIVE AGNETS E. R. SQUIBB & SONS, INC. (US) 1986-08-05 — — US disclosed
EP-0159156-A1 Hydroxy substituted ureido amino and imino acids E.R. Squibb & Sons, Inc. (US) 1985-10-23 — — EP disclosed
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