SCHEMBL31379433

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(C)C)[C@@H](C)O)C(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	NMBR	P28336	2/20	0.70

▸	GRPR	P30550	2/20	0.70

▸	C5AR1	P21730	2/20	0.68

▸	CRHR1	P34998	1/20	0.65

▸	CRHR2	Q13324	1/20	0.65

▸	GLP1R	P43220	9/20	0.64

▸	GCGR	P47871	3/20	0.64

▸	CALCR	P30988	3/20	0.64

▸	HCRTR1	O43613	1/20	0.59

▸	HCRTR2	O43614	1/20	0.59

▸	CCKBR	P32239	4/20	0.59

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
SCHEMBL29599666	0.94	GLP1R (0.70)	NMBRGRPRC5AR1GLP1RGCGR
SCHEMBL29462210	0.89	NMBR (0.77)	NMBRGRPRC5AR1CRHR1CRHR2
SCHEMBL29464570	0.88	NPY2R (0.71)	GLP1RCALCR
SCHEMBL30261974	0.88	CALCR (0.63)	NMBRGRPRC5AR1GLP1RGCGR
SCHEMBL30262076	0.87	C5AR1 (0.62)	NMBRGRPRC5AR1GLP1RGCGR
Cosyntropin SCHEMBL30506076	0.86	C5AR1 (0.72)	NMBRGRPRC5AR1CRHR1CRHR2
SCHEMBL29827295	0.86	CALCR (0.73)	CRHR1CRHR2GLP1RGCGRCALCR
SCHEMBL31182829	0.86	GLP1R (0.73)	C5AR1GLP1RGCGRCALCRCCKBR
SCHEMBL23273229	0.86	NMBR (0.69)	NMBRGRPRC5AR1GLP1RGCGR
SCHEMBL4956503	0.85	GLP1R (0.61)	NMBRGRPRC5AR1GLP1RGCGR

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
WO-2025040649-A1	NEUROPEPTIDE B AND W-RECEPTOR AS A TARGET FOR TREATING MOOD DISORDERS AND/OR CHRONIC STRESS	FRIEDRICH-SCHILLER-UNIVERSITÄT JENA (DE)	2025-02-27	—	—	WO	disclosed
EP-4512403-A1	NEUROPEPTIDE B AND W-RECEPTOR AS A TARGET FOR TREATING MOOD DISORDERS AND/OR CHRONIC STRESS	Friedrich-Schiller-Universität Jena (DE)	2025-02-26	—	—	EP	disclosed