SCHEMBL29569348

CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR1	P30989	6/20	0.59

▸	NTSR2	O95665	5/20	0.59

▸	SORT1	Q99523	3/20	0.59

▸	REN	P00797	5/20	0.58

▸	OPRM1	P35372	1/20	0.57

▸	OPRD1	P41143	1/20	0.57

▸	OPRK1	P41145	1/20	0.57

▸	F2	P00734	4/20	0.57

▸	AGTR1	P30556	1/20	0.56

▸	AGTR2	P50052	1/20	0.56

▸	C5AR1	P21730	1/20	0.56

▸	CALCR	P30988	2/20	0.55

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
SCHEMBL29568673	0.97	NTSR1 (0.61)	NTSR1NTSR2SORT1RENOPRM1
SCHEMBL29569425	0.97	NTSR1 (0.58)	NTSR1NTSR2SORT1RENOPRM1
SCHEMBL29568453	0.96	REN (0.62)	NTSR1NTSR2SORT1RENOPRM1
SCHEMBL29569971	0.95	OPRD1 (0.63)	NTSR1NTSR2SORT1RENOPRM1
SCHEMBL29569380	0.92	REN (0.62)	NTSR1NTSR2SORT1RENOPRM1
SCHEMBL29568867	0.92	REN (0.62)	NTSR1NTSR2SORT1RENOPRM1
SCHEMBL29568664	0.92	REN (0.62)	NTSR1NTSR2SORT1RENOPRM1
SCHEMBL29568825	0.91	REN (0.61)	NTSR1NTSR2SORT1RENOPRM1
SCHEMBL29569641	0.91	REN (0.61)	NTSR1NTSR2SORT1RENOPRM1
SCHEMBL29568971	0.91	REN (0.60)	NTSR1NTSR2RENF2AGTR1

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-3320923-B1	FLUORESCENT IMAGING AGENTS	VISEN MEDICAL INC (US)	2022-04-06	—	—	EP	disclosed