SCHEMBL10844071

SCHEMBL10844071

CN(CC(O)C(CCCCN)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 14/20 0.51
▸ ACE2 Q9BYF1 6/20 0.47

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
SCHEMBL10845579 0.92 ACE (0.52) ACEACE2
SCHEMBL10846942 0.86 ACE (0.58) ACEACE2
SCHEMBL10846517 0.85 DPP4 (0.47) ACEACE2
SCHEMBL10849422 0.83 ACE (0.58) ACEACE2
SCHEMBL10663756 0.83 ACE (0.54) ACEACE2
SCHEMBL10847172 0.81 ACE (0.51) ACEACE2
SCHEMBL10847513 0.80 ACE (0.60) ACEACE2
SCHEMBL10844765 0.79 ACE (0.56) ACEACE2
SCHEMBL10836346 0.79 CYP2C19 (0.47) ACEACE2
SCHEMBL10847405 0.79 ACE (0.61) 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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