SCHEMBL30093409

CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	F13A1	P00488	2/20	0.56

▸	TGM2	P21980	2/20	0.56

▸	REN	P00797	1/20	0.55

▸	NTSR2	O95665	8/20	0.55

▸	NTSR1	P30989	8/20	0.55

▸	SORT1	Q99523	8/20	0.55

▸	DPP3	Q9NY33	5/20	0.54

▸	CAPN1	P07384	2/20	0.52

▸	CTSB	P07858	2/20	0.52

▸	EDNRA	P25101	1/20	0.49

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
SCHEMBL30093405	0.95	F13A1 (0.58)	F13A1TGM2RENNTSR2NTSR1
SCHEMBL30051283	0.89	DPP3 (0.61)	NTSR2NTSR1SORT1DPP3CAPN1
SCHEMBL30051435	0.86	DPP4 (0.58)	F13A1TGM2NTSR2NTSR1SORT1
SCHEMBL30439190	0.86	F13A1 (0.59)	F13A1TGM2RENNTSR2NTSR1
SCHEMBL32681272	0.86	DPP3 (0.62)	F13A1TGM2NTSR2NTSR1SORT1
SCHEMBL31303834	0.85	DPP3 (0.59)	F13A1TGM2RENNTSR2NTSR1
SCHEMBL30441566	0.84	CAPN1 (0.63)	F13A1TGM2RENNTSR2NTSR1
SCHEMBL30051442	0.84	DPP4 (0.62)	NTSR2NTSR1SORT1DPP3
SCHEMBL31326864	0.83	DPP3 (0.56)	F13A1TGM2RENNTSR2NTSR1
SCHEMBL30483549	0.83	DPP3 (0.58)	F13A1TGM2NTSR2NTSR1SORT1

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-2022244341-A1	PEPTIDE AND MEDICINAL COMPOSITION	国立大学法人北海道大学	2022-11-24	—	—	WO	disclosed