SCHEMBL29939673

CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	KISS1R	Q969F8	15/20	0.57

▸	TFPI	P10646	1/20	0.56

▸	OPRD1	P41143	1/20	0.54

▸	BACE1	P56817	3/20	0.53

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
SCHEMBL30038873	0.92	NPY4R (0.57)	KISS1ROPRD1
SCHEMBL30973981	0.88	NPY4R (0.56)	TFPIBACE1
SCHEMBL29679768	0.87	BACE1 (0.50)	KISS1RTFPIBACE1
SCHEMBL30880877	0.87	BACE1 (0.59)	KISS1RTFPIBACE1
SCHEMBL30037959	0.87	NPY4R (0.61)	KISS1RBACE1
SCHEMBL29679856	0.87	NPY1R (0.58)	KISS1RBACE1
SCHEMBL29679778	0.87	BACE1 (0.53)	KISS1RBACE1
SCHEMBL30607418	0.87	BACE1 (0.60)	KISS1RTFPIBACE1
SCHEMBL30350938	0.86	KISS1R (0.57)	KISS1ROPRD1BACE1
SCHEMBL30974256	0.86	NPY4R (0.51)	BACE1

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-115066254-A	Human anti-inflammatory peptides for inhalation treatment of inflammatory lung diseases	阿德维塔生命科学有限责任公司	2022-09-16	—	—	CN	disclosed