SCHEMBL30667529

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@@H](C)CC)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	8/20	0.56

▸	CTSD	P07339	6/20	0.56

▸	GRB2	P62993	1/20	0.53

▸	KISS1R	Q969F8	2/20	0.53

▸	OPRD1	P41143	1/20	0.51

▸	BACE2	Q9Y5Z0	1/20	0.51

▸	CALCRL	Q16602	1/20	0.50

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
SCHEMBL30787545	0.90	BACE1 (0.65)	BACE1CTSDBACE2
SCHEMBL30839324	0.87	BACE1 (0.59)	BACE1CTSDBACE2
SCHEMBL30646465	0.85	CTSD (0.52)	BACE1CTSDGRB2KISS1R
SCHEMBL30544642	0.85	CTSD (0.56)	BACE1CTSDGRB2KISS1R
SCHEMBL9848670	0.85	OPRD1 (0.61)	BACE1CTSDGRB2KISS1ROPRD1
SCHEMBL29416012	0.84	KISS1R (0.57)	BACE1CTSDKISS1R
SCHEMBL30655941	0.84	CTSD (0.57)	BACE1CTSD
SCHEMBL30493684	0.84	CTSD (0.52)	BACE1CTSDBACE2
SCHEMBL38661730	0.84	BACE1 (0.67)	BACE1CTSDBACE2
SCHEMBL29848441	0.84	BACE1 (0.63)	BACE1CTSDKISS1RBACE2

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
WO-2023222134-A1	PEPTOID COMPOUND AND USE THEREOF	杭州禾泰健宇生物科技有限公司	2023-11-23	—	—	WO	disclosed