SCHEMBL31606491

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	C5AR1	P21730	2/20	0.61

▸	NPY1R	P25929	1/20	0.59

▸	NPY2R	P49146	1/20	0.59

▸	NPY4R	P50391	1/20	0.59

▸	NPY5R	Q15761	1/20	0.59

▸	MC4R	P32245	2/20	0.57

▸	MC5R	P33032	2/20	0.57

▸	MC3R	P41968	2/20	0.57

▸	MC1R	Q01726	2/20	0.57

▸	CXCR4	P61073	7/20	0.57

▸	KEAP1	Q14145	1/20	0.56

▸	KISS1R	Q969F8	3/20	0.55

▸	GLP1R	P43220	2/20	0.55

▸	EPHA2	P29317	1/20	0.55

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
SCHEMBL31606485	0.93	CXCL8 (0.56)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL29827497	0.89	NPY2R (0.69)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL29637829	0.88	C5AR1 (0.68)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL31688315	0.88	NPY2R (0.64)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL31606493	0.88	KISS1R (0.55)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL31694492	0.86	KEAP1 (0.70)	NPY1RNPY2RNPY4RNPY5RCXCR4
SCHEMBL30903283	0.86	C5AR1 (0.68)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL30176440	0.86	NPY1R (0.64)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL31419719	0.86	NPY1R (0.62)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL29444580	0.86	C5AR1 (0.62)	C5AR1NPY1RNPY2RNPY4RNPY5R

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-2025109003-A1	P-CADHERIN LIGANDS	3B PHARMACEUTICALS GMBH (DE)	2025-05-30	—	—	WO	disclosed