SCHEMBL8313993

CC(=O)S[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN2CCC[C@@H](C(=O)O)N2C1=O.O=C(NC1CCCN2CCCC(C(=O)O)N2C1=O)C(=S)Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	ACE	P12821	9/20	0.61

▸	MME	P08473	6/20	0.61

▸	APP	P05067	1/20	0.41

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.

Compound	similarity	top predicted	shared targets
SCHEMBL7353943	0.92	ACE (0.71)	ACEMMEAPP
SCHEMBL7347869	0.92	ACE (0.71)	ACEMMEAPP
SCHEMBL7351831	0.92	ACE (0.71)	ACEMMEAPP
SCHEMBL7339343	0.92	ACE (0.71)	ACEMMEAPP
SCHEMBL7347478	0.89	ACE (0.67)	ACEMMEAPP
SCHEMBL7377620	0.89	ACE (0.67)	ACEMMEAPP
SCHEMBL7373963	0.89	ACE (0.72)	ACEMME
SCHEMBL8314652	0.86	ACE (0.64)	ACEMMEAPP
SCHEMBL7348133	0.86	ACE (0.64)	ACEMMEAPP
SCHEMBL7374201	0.86	ACE (0.62)	ACEMMEAPP

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 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0640086-B1	MERCAPTOACETYLAMIDO PYRIDAZO[ 1,2-a][1,2]DIAZEPINE DERIVATIVES USEFUL AS INHIBITORS OF ENKEPHALINASE AND ACE	MERRELL PHARMA INC (US)	1999-08-04	—	—	EP	claimed