SCHEMBL29608399

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

nearest known ligand 0.55

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR2	O95665	17/20	0.55

▸	NTSR1	P30989	17/20	0.55

▸	SORT1	Q99523	17/20	0.55

▸	APLNR	P35414	1/20	0.53

▸	F2	P00734	2/20	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
SCHEMBL29608084	0.94	APLNR (0.50)	NTSR2NTSR1SORT1APLNRF2
SCHEMBL29608877	0.94	APLNR (0.50)	NTSR2NTSR1SORT1APLNRF2
SCHEMBL29607837	0.93	APLNR (0.49)	NTSR2NTSR1SORT1APLNRF2
SCHEMBL29608099	0.90	APLNR (0.50)	NTSR2NTSR1SORT1APLNRF2
SCHEMBL29608153	0.89	REN (0.51)	NTSR2NTSR1SORT1F2
SCHEMBL29607498	0.88	C5AR1 (0.55)	NTSR2NTSR1SORT1APLNR
SCHEMBL30512494	0.88	MAPK8 (0.54)	APLNRF2
SCHEMBL29607195	0.88	C5AR1 (0.56)	NTSR2NTSR1SORT1APLNRF2
SCHEMBL29607122	0.87	C5AR1 (0.56)	APLNRF2
SCHEMBL29606806	0.87	C5AR1 (0.54)	APLNR

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-20220120732-A1	TREATMENT OF DISEASES WITH MULTIMERIC PEPTIDES	RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL)	2022-04-21	—	—	US	disclosed