SCHEMBL8450803

CC(C)CN(C[C@H](OCc1ccccc1)C(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)O)C(Cc1ccccc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	MME	P08473	7/20	0.48

▸	ACE	P12821	6/20	0.48

▸	CTSB	P07858	1/20	0.42

▸	FDFT1	P37268	1/20	0.39

▸	PSMB5	P28074	1/20	0.39

▸	CTSL	P07711	1/20	0.38

▸	CTSK	P43235	1/20	0.38

▸	MEN1	O00255	1/20	0.37

▸	KMT2A	Q03164	1/20	0.37

▸	ACACB	O00763	1/20	0.37

▸	ECE1	P42892	2/20	0.36

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
SCHEMBL8446471	0.95	MME (0.47)	MMEACECTSBFDFT1CTSL
SCHEMBL8446405	0.93	MME (0.48)	MMEACECTSBFDFT1CTSL
SCHEMBL8449676	0.91	MME (0.48)	MMEACECTSBFDFT1PSMB5
SCHEMBL8446421	0.90	MME (0.43)	MMEACECTSBFDFT1PSMB5
SCHEMBL8446382	0.90	MME (0.51)	MMEACECTSBFDFT1CTSL
SCHEMBL8447086	0.89	MME (0.44)	MMEACECTSBFDFT1PSMB5
SCHEMBL8450840	0.89	MME (0.46)	MMEACECTSBPSMB5CTSL
SCHEMBL7572261	0.86	MME (0.66)	MMEACECTSB
SCHEMBL7572256	0.86	MME (0.66)	MMEACECTSB
SCHEMBL8450247	0.86	MME (0.47)	MMEACECTSBFDFT1CTSL

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
US-5968980-A	ENDOPEPTIDASE 24.11 INHIBITORS	SANTEN PHARMACEUTICAL CO., LTD. (JP)	1999-10-19	—	—	US	disclosed