SCHEMBL29727282

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.52

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR2	O95665	10/20	0.52

▸	NTSR1	P30989	10/20	0.52

▸	SORT1	Q99523	9/20	0.52

▸	CALCRL	Q16602	3/20	0.51

▸	OPRD1	P41143	3/20	0.49

▸	AGTR1	P30556	3/20	0.49

▸	AGTR2	P50052	3/20	0.49

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
SCHEMBL31362700	0.95	NTSR2 (0.51)	NTSR2NTSR1SORT1CALCRLOPRD1
SCHEMBL31362702	0.93	MAPK8 (0.51)	NTSR2NTSR1SORT1CALCRLOPRD1
SCHEMBL31362672	0.89	NMUR2 (0.50)	CALCRLOPRD1AGTR1AGTR2
SCHEMBL28594198	0.88	NTSR2 (0.50)	NTSR2NTSR1SORT1CALCRLOPRD1
SCHEMBL30015256	0.88	MAPK8 (0.56)	OPRD1
SCHEMBL31362692	0.87	ACE (0.49)	OPRD1
SCHEMBL6387838	0.86	AGTR1 (0.49)	NTSR2NTSR1SORT1CALCRLOPRD1
SCHEMBL6387835	0.86	AGTR1 (0.49)	NTSR2NTSR1SORT1CALCRLOPRD1
SCHEMBL30459251	0.85	REN (0.53)	NTSR2NTSR1SORT1OPRD1AGTR1
SCHEMBL38660201	0.85	AGTR1 (0.50)	NTSR2NTSR1SORT1OPRD1AGTR1

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
CN-107105707-B	Proline tolerant tripeptidylpeptidases and uses thereof	杜邦营养生物科学有限公司	2022-07-22	—	—	CN	disclosed
US-20220174981-A1	PROLINE TOLERANT TRIPEPTIDYL PEPTIDASES AND USES THEREOF	DUPONT NUTRITION BIOSCIENCES APS (DK)	2022-06-09	—	—	US	disclosed