SCHEMBL29533733

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

nearest known ligand 0.78

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	MC4R	P32245	3/20	0.78

▸	MC5R	P33032	2/20	0.78

▸	MC3R	P41968	2/20	0.78

▸	MC1R	Q01726	2/20	0.78

▸	C5AR1	P21730	2/20	0.76

▸	CTSL	P07711	3/20	0.66

▸	CTSS	P25774	3/20	0.66

▸	CTSK	P43235	3/20	0.66

▸	CTSH	P09668	1/20	0.66

▸	GLP1R	P43220	4/20	0.64

▸	GCGR	P47871	3/20	0.63

▸	CXCR4	P61073	4/20	0.62

▸	KEAP1	Q14145	1/20	0.59

▸	IL23R	Q5VWK5	1/20	0.59

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
SCHEMBL29430238	0.98	MC4R (0.78)	MC4RMC5RMC3RMC1RC5AR1
Intermedine SCHEMBL20548027	0.96	MC4R (0.82)	MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29358645	0.96	MC4R (0.82)	MC4RMC5RMC3RMC1RC5AR1
Intermedine SCHEMBL22076809	0.96	MC4R (0.82)	MC4RMC5RMC3RMC1RC5AR1
Codactide SCHEMBL29409825	0.96	MC4R (0.74)	MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29533861	0.96	C5AR1 (0.74)	MC4RMC5RMC3RMC1RC5AR1
SCHEMBL18388638	0.96	C5AR1 (0.74)	MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29533782	0.96	C5AR1 (0.77)	MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29973172	0.95	C5AR1 (0.77)	MC4RMC5RMC3RMC1RC5AR1
SCHEMBL30017682	0.95	C5AR1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-20220133839-A1	PEPTIDE ANALOGUES WITH BRANCHED AMINO ACID PROBE(S)	TXP PHARMA GMBH (CH)	2022-05-05	—	—	US	disclosed