SCHEMBL30903284

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.60

Predicted protein targets (top 18)

	gene	UniProt	supporting neighbours	confidence
▸	MAPK8	P45983	1/20	0.60

▸	MAPK9	P45984	1/20	0.60

▸	MAPK10	P53779	1/20	0.60

▸	C5AR1	P21730	1/20	0.59

▸	EED	O75530	1/20	0.57

▸	NPY1R	P25929	1/20	0.57

▸	NPY2R	P49146	1/20	0.57

▸	NPY4R	P50391	1/20	0.57

▸	NPY5R	Q15761	1/20	0.57

▸	KISS1R	Q969F8	3/20	0.56

▸	KDM1A	O60341	2/20	0.56

▸	GLP1R	P43220	4/20	0.56

▸	REN	P00797	4/20	0.56

▸	GCGR	P47871	1/20	0.55

▸	GIPR	P48546	1/20	0.55

▸	CXCR4	P61073	1/20	0.55

▸	KEAP1	Q14145	1/20	0.55

▸	CCKBR	P32239	2/20	0.54

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
SCHEMBL29811075	0.97	NPY1R (0.61)	MAPK8MAPK9MAPK10C5AR1EED
SCHEMBL30717240	0.90	C5AR1 (0.63)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL30903283	0.90	C5AR1 (0.68)	C5AR1EEDNPY1RNPY2RNPY4R
SCHEMBL30436426	0.89	GLP1R (0.66)	NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL29965312	0.89	NPY1R (0.68)	C5AR1EEDNPY1RNPY2RNPY4R
SCHEMBL29637829	0.88	C5AR1 (0.68)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL31476431	0.87	C5AR1 (0.58)	C5AR1NPY2RKISS1RGLP1R
SCHEMBL30859276	0.87	NPY1R (0.65)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL31402803	0.86	GLP1R (0.69)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL30607395	0.86	GLP1R (0.60)	MAPK8MAPK9MAPK10NPY1RNPY2R

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-20240148849-A1	IMMUNOGENIC COMPOSITION, USE AND METHODS	GLAXOSMITHKLINE BIOLOGICALS SA (BE)	2024-05-09	—	—	US	disclosed