SCHEMBL30239262

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR1	P30989	8/20	0.48

▸	NTSR2	O95665	6/20	0.48

▸	SORT1	Q99523	3/20	0.48

▸	XIAP	P98170	1/20	0.47

▸	REN	P00797	9/20	0.46

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
SCHEMBL30239685	0.90	XIAP (0.47)	NTSR1NTSR2SORT1XIAPREN
SCHEMBL31433252	0.85	GRB2 (0.50)	NTSR1NTSR2SORT1
SCHEMBL31257010	0.85	XIAP (0.57)	NTSR1NTSR2SORT1XIAPREN
SCHEMBL31433238	0.84	GRB2 (0.51)	NTSR1NTSR2SORT1XIAP
SCHEMBL24725155	0.84	NTSR1 (0.47)	NTSR1NTSR2SORT1XIAP
SCHEMBL31433348	0.83	CALCR (0.45)	NTSR1NTSR2SORT1
SCHEMBL31433333	0.83	CALCR (0.46)	NTSR1NTSR2SORT1
SCHEMBL30075936	0.82	PTPN1 (0.47)	NTSR1NTSR2SORT1XIAPREN
SCHEMBL30512794	0.82	NTSR1 (0.49)	NTSR1NTSR2SORT1
SCHEMBL29914211	0.82	PTPN1 (0.48)	NTSR1NTSR2SORT1XIAP

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-115785215-A	Mussel peptide and preparation method and application thereof	青岛琛蓝生物科技有限公司	2023-03-14	—	—	CN	claimed
CN-115785215-A	Mussel peptide and preparation method and application thereof	青岛琛蓝生物科技有限公司	2023-03-14	—	—	CN	disclosed
CN-115785215-A	Mussel peptide and preparation method and application thereof	青岛琛蓝生物科技有限公司	2023-03-14	—	—	CN	disclosed