SCHEMBL29454474

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)C(C)C

nearest known ligand 0.61

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR1	P30989	19/20	0.61

▸	NTSR2	O95665	18/20	0.61

▸	SORT1	Q99523	16/20	0.61

▸	AGTR1	P30556	1/20	0.56

▸	AGTR2	P50052	1/20	0.56

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
SCHEMBL29737358	0.95	NTSR1 (0.58)	NTSR1NTSR2SORT1AGTR1AGTR2
SCHEMBL29737339	0.95	NTSR1 (0.66)	NTSR1NTSR2SORT1
SCHEMBL29737386	0.93	NTSR1 (0.61)	NTSR1NTSR2SORT1
SCHEMBL29737362	0.93	AGTR2 (0.57)	NTSR1NTSR2SORT1AGTR1AGTR2
SCHEMBL29947193	0.92	AGTR2 (0.58)	NTSR1NTSR2SORT1AGTR1AGTR2
SCHEMBL29737369	0.91	NTSR2 (0.70)	NTSR1NTSR2SORT1
SCHEMBL29737361	0.91	NTSR1 (0.70)	NTSR1NTSR2SORT1
SCHEMBL29737356	0.90	NPY1R (0.53)	NTSR1NTSR2SORT1AGTR1AGTR2
SCHEMBL29737420	0.87	SLC6A2 (0.57)	NTSR1NTSR2AGTR1AGTR2
SCHEMBL29737347	0.87	NTSR2 (0.68)	NTSR1NTSR2SORT1

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-3970801-A1	RAS INHIBITORY PEPTIDE	Ichimaru Pharcos Co., Ltd. (JP)	2022-03-23	—	—	EP	disclosed