SCHEMBL31653878

CSCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.75

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	5/20	0.75

▸	CRHR1	P34998	1/20	0.64

▸	CRHR2	Q13324	1/20	0.64

▸	F2	P00734	4/20	0.61

▸	HCRTR1	O43613	1/20	0.61

▸	HCRTR2	O43614	1/20	0.61

▸	CCKBR	P32239	4/20	0.58

▸	GLP1R	P43220	4/20	0.58

▸	APLNR	P35414	1/20	0.57

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
SCHEMBL31182637	0.92	CALCR (0.77)	CALCRCRHR1CRHR2F2HCRTR1
SCHEMBL31457381	0.89	GLP1R (0.72)	CALCRCCKBRGLP1R
SCHEMBL31082468	0.89	CALCR (0.75)	CALCRCRHR1CRHR2F2HCRTR1
SCHEMBL30576931	0.88	F2 (0.73)	CALCRCRHR1CRHR2F2HCRTR1
SCHEMBL30712968	0.88	CALCR (0.75)	CALCRCRHR1CRHR2F2CCKBR
SCHEMBL29413135	0.88	CALCR (0.76)	CALCRCRHR1CRHR2GLP1R
SCHEMBL29624204	0.88	CALCR (0.76)	CALCRCRHR1CRHR2GLP1R
SCHEMBL29794830	0.88	CALCR (0.76)	CALCRCRHR1CRHR2F2HCRTR1
SCHEMBL2448693	0.88	CALCR (0.71)	CALCRCRHR1CRHR2F2HCRTR1
SCHEMBL29939733	0.88	CALCR (0.73)	CALCRCRHR1CRHR2F2HCRTR1

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
US-20250213654-A1	PEPTIDES AND METHODS FOR USE IN TREATING PAIN	CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR)	2025-07-03	—	—	US	disclosed