SCHEMBL31276124

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR1	P30989	6/20	0.57

▸	NTSR2	O95665	5/20	0.57

▸	SORT1	Q99523	4/20	0.57

▸	AGTR1	P30556	3/20	0.53

▸	AGTR2	P50052	3/20	0.53

▸	REN	P00797	5/20	0.53

▸	OPRD1	P41143	2/20	0.51

▸	OPRM1	P35372	1/20	0.51

▸	OPRK1	P41145	1/20	0.51

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
SCHEMBL1939264	0.87	F2 (0.60)	NTSR1NTSR2SORT1RENOPRD1
SCHEMBL1939266	0.87	F2 (0.60)	NTSR1NTSR2SORT1RENOPRD1
SCHEMBL27846710	0.87	F2 (0.60)	NTSR1NTSR2SORT1RENOPRD1
SCHEMBL30173224	0.86	OPRD1 (0.61)	OPRD1OPRM1
SCHEMBL30361670	0.85	NTSR1 (0.64)	NTSR1NTSR2SORT1
SCHEMBL30439368	0.84	OPRK1 (0.58)	NTSR1NTSR2SORT1RENOPRK1
SCHEMBL30881940	0.83	REN (0.61)	NTSR1NTSR2SORT1AGTR1AGTR2
SCHEMBL15270931	0.83	LNPEP (0.52)	AGTR1AGTR2REN
SCHEMBL15270934	0.83	LNPEP (0.52)	AGTR1AGTR2REN
SCHEMBL10305352	0.82	NTSR1 (0.65)	NTSR1NTSR2SORT1RENOPRD1

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-2025015401-A1	A METHOD OF IDENTIFYING HPV BIOMARKERS, A METHOD OF PREPARING A LATERAL FLOW DEVICE, SAID DEVICE AND A DIAGNOSTIC KIT	UNIVERSIDADE ESTADUAL DE CAMPINAS (BR)	2025-01-23	—	—	WO	disclosed