SCHEMBL30512516

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(C)C

nearest known ligand 0.46

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	1/20	0.46

▸	GLP1R	P43220	8/20	0.44

▸	CALCR	P30988	4/20	0.43

▸	CRHR1	P34998	1/20	0.43

▸	CRHR2	Q13324	1/20	0.43

▸	MAGI3	Q5TCQ9	1/20	0.42

▸	VIPR1	P32241	1/20	0.42

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
SCHEMBL29557080	0.90	BACE1 (0.40)	BACE1GLP1RCALCR
SCHEMBL29557273	0.89	GLP1R (0.41)	BACE1GLP1RCALCR
SCHEMBL30432541	0.88	GLP1R (0.52)	GLP1RCALCRCRHR1CRHR2VIPR1
SCHEMBL30974504	0.88	BACE1 (0.45)	BACE1GLP1R
SCHEMBL30810354	0.88	GLP1R (0.43)	BACE1GLP1RCALCRCRHR1CRHR2
SCHEMBL29478145	0.87	SLC15A2 (0.40)	BACE1GLP1R
SCHEMBL29531170	0.87	SLC15A2 (0.39)	BACE1
SCHEMBL30240002	0.86	ENPEP (0.43)	BACE1GLP1RVIPR1
SCHEMBL29530561	0.86	SLC15A2 (0.39)	GLP1RCALCRCRHR1CRHR2
SCHEMBL29381521	0.85	BACE1 (0.40)	BACE1GLP1RCRHR1CRHR2

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
CN-116490215-A	Targeted mediated endocytic drug delivery	CRM医疗有限公司	2023-07-25	—	—	CN	disclosed