SCHEMBL31606485

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)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 0.56

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CXCL8	P10145	10/20	0.56

▸	C5AR1	P21730	2/20	0.55

▸	NPY1R	P25929	1/20	0.55

▸	NPY2R	P49146	1/20	0.55

▸	NPY4R	P50391	1/20	0.55

▸	NPY5R	Q15761	1/20	0.55

▸	KISS1R	Q969F8	3/20	0.53

▸	CXCR4	P61073	1/20	0.53

▸	CALCR	P30988	2/20	0.52

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
SCHEMBL31606491	0.93	C5AR1 (0.61)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL31606514	0.90	KISS1R (0.55)	CXCL8KISS1R
SCHEMBL31606503	0.90	AGTR1 (0.58)	CXCL8KISS1R
SCHEMBL31606513	0.89	KISS1R (0.54)	CXCL8KISS1R
SCHEMBL31606523	0.88	KISS1R (0.56)	CXCL8NPY1RNPY2RNPY4RNPY5R
SCHEMBL31606474	0.87	AGTR1 (0.56)	CXCL8KISS1R
SCHEMBL31606498	0.87	CXCL8 (0.54)	CXCL8KISS1R
SCHEMBL30262151	0.86	KISS1R (0.59)	CXCL8NPY1RNPY2RNPY4RNPY5R
SCHEMBL29679866	0.86	NPY1R (0.72)	NPY1RNPY2RNPY4RNPY5RCALCR
SCHEMBL29679514	0.85	NPY1R (0.68)	NPY1RNPY2RNPY4RNPY5RCALCR

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