SCHEMBL31679481

CCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](N)CS)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	8/20	0.55

▸	OPRM1	P35372	2/20	0.51

▸	NTSR1	P30989	2/20	0.51

▸	CALCR	P30988	3/20	0.51

▸	NTSR2	O95665	1/20	0.50

▸	AGTR1	P30556	1/20	0.49

▸	AGTR2	P50052	1/20	0.49

▸	F2	P00734	1/20	0.48

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
SCHEMBL31679438	0.95	AGTR2 (0.53)	OPRD1NTSR1NTSR2AGTR1AGTR2
SCHEMBL31679348	0.93	AGTR2 (0.54)	OPRD1NTSR1NTSR2AGTR1AGTR2
SCHEMBL31679433	0.93	NTSR1 (0.54)	OPRD1OPRM1NTSR1NTSR2AGTR1
SCHEMBL31679352	0.93	AGTR2 (0.52)	OPRD1NTSR1NTSR2AGTR1AGTR2
SCHEMBL31679341	0.92	AGTR2 (0.52)	OPRD1NTSR1NTSR2AGTR1AGTR2
SCHEMBL31679360	0.91	OPRD1 (0.55)	OPRD1OPRM1NTSR1NTSR2AGTR1
SCHEMBL31679423	0.91	AGTR2 (0.51)	OPRD1NTSR1NTSR2AGTR1AGTR2
SCHEMBL31679422	0.90	AGTR2 (0.52)	OPRD1NTSR1NTSR2AGTR1AGTR2
SCHEMBL31679384	0.90	NTSR1 (0.52)	NTSR1NTSR2AGTR1AGTR2F2
SCHEMBL31679451	0.90	AGTR2 (0.52)	OPRD1NTSR1NTSR2AGTR1AGTR2

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
EP-4610269-A1	UROKINASE PLASMINOGEN ACTIVATOR SURFACE RECEPTOR (UPAR) LIGANDS FOR DIAGNOSTIC OR THERAPEUTIC USE	3B Pharmaceuticals GmbH (DE)	2025-09-03	—	—	EP	disclosed