SCHEMBL29973282

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC

nearest known ligand 0.56

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	EDNRA	P25101	1/20	0.56

▸	GLP1R	P43220	15/20	0.55

▸	IL23R	Q5VWK5	1/20	0.53

▸	KISS1R	Q969F8	2/20	0.51

▸	IL1RN	P18510	1/20	0.50

▸	ERAP2	Q6P179	1/20	0.50

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
SCHEMBL29973471	0.94	GLP1R (0.60)	GLP1RIL23R
SCHEMBL29973297	0.92	GLP1R (0.62)	GLP1R
SCHEMBL7261793	0.92	EDNRA (0.65)	EDNRAGLP1RIL1RNERAP2
SCHEMBL7261791	0.92	EDNRA (0.65)	EDNRAGLP1RIL1RNERAP2
SCHEMBL29973096	0.91	GLP1R (0.60)	EDNRAGLP1R
SCHEMBL30423068	0.91	GLP1R (0.59)	EDNRAGLP1R
SCHEMBL29972957	0.90	GLP1R (0.62)	GLP1R
SCHEMBL29565282	0.89	GLP1R (0.60)	GLP1R
SCHEMBL31376429	0.87	PTH1R (0.60)	GLP1R
SCHEMBL30045857	0.87	EDNRA (0.68)	EDNRAGLP1RIL1RNERAP2

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
EP-4067370-A1	HIGH PENETRATION PRODRUG COMPOSITIONS OF PEPTIDES AND PEPTIDE RELATED COMPOUNDS	Yu, Chongxi (US)	2022-10-05	—	—	EP	disclosed