SCHEMBL30750450

CCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(N)=O)C(C)C

nearest known ligand 0.71

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	MC4R	P32245	3/20	0.71

▸	MC5R	P33032	2/20	0.71

▸	MC3R	P41968	2/20	0.71

▸	MC1R	Q01726	2/20	0.71

▸	C5AR1	P21730	2/20	0.65

▸	IL23R	Q5VWK5	3/20	0.58

▸	CALCA	P06881	2/20	0.57

▸	GLP1R	P43220	3/20	0.56

▸	GCGR	P47871	3/20	0.56

▸	CXCR4	P61073	4/20	0.56

▸	NMBR	P28336	1/20	0.55

▸	GRPR	P30550	1/20	0.55

▸	TFPI	P10646	1/20	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
SCHEMBL30750506	0.97	MC4R (0.73)	MC4RMC5RMC3RMC1RC5AR1
SCHEMBL30464986	0.96	MC4R (0.65)	MC4RMC5RMC3RMC1RC5AR1
SCHEMBL30464996	0.94	MC4R (0.67)	MC4RMC5RMC3RMC1RC5AR1
Afamelanotide SCHEMBL22463810	0.93	MC4R (0.81)	MC4RMC5RMC3RMC1RC5AR1
Afamelanotide SCHEMBL29419548	0.93	MC4R (0.81)	MC4RMC5RMC3RMC1RC5AR1
Afamelanotide SCHEMBL29352792	0.93	MC4R (0.81)	MC4RMC5RMC3RMC1RC5AR1
Afamelanotide SCHEMBL22463811	0.93	MC4R (0.81)	MC4RMC5RMC3RMC1RC5AR1
Afamelanotide SCHEMBL29533175	0.92	MC4R (0.80)	MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29970570	0.90	MC4R (0.77)	MC4RMC5RMC3RMC1RC5AR1
SCHEMBL18281742	0.89	MC4R (0.77)	MC4RMC5RMC3RMC1RC5AR1

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
EP-3573645-B1	ALPHA-MSH ANALOGUES USED IN THE TREATMENT OF XERODERMA PIGMENTOSUM	VALLAURIX MC S A R L (MC)	2024-03-13	—	—	EP	disclosed
EP-3030256-B1	NDP-MSH FOR USE IN THE TREATMENT OF MULTIPLE SCLEROSIS	CLINUVEL PHARMACEUTICALS LTD (AU)	2024-01-24	—	—	EP	disclosed