SCHEMBL17082298

CC(NC(=O)CNC(=O)C(Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)C(C)NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](C)C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	13/20	0.58

▸	OPRM1	P35372	7/20	0.58

▸	OPRK1	P41145	1/20	0.58

▸	NPY5R	Q15761	3/20	0.47

▸	NPY1R	P25929	2/20	0.47

▸	NPY4R	P50391	2/20	0.47

▸	CHRND	Q07001	1/20	0.45

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
SCHEMBL17082301	0.89	OPRD1 (0.57)	OPRD1OPRM1OPRK1CHRND
SCHEMBL30444397	0.86	OPRD1 (0.64)	OPRD1OPRM1OPRK1
SCHEMBL30440289	0.83	OPRD1 (0.56)	OPRD1OPRM1OPRK1
SCHEMBL30082266	0.83	OPRD1 (0.64)	OPRD1OPRM1OPRK1
SCHEMBL30082352	0.83	OPRD1 (0.64)	OPRD1OPRM1OPRK1
SCHEMBL30082355	0.83	OPRD1 (0.64)	OPRD1OPRM1OPRK1
SCHEMBL30417283	0.82	OPRD1 (0.55)	OPRD1OPRM1OPRK1
SCHEMBL30417716	0.82	OPRD1 (0.55)	OPRD1OPRM1OPRK1
SCHEMBL17074564	0.82	OPRD1 (0.65)	OPRD1OPRM1OPRK1NPY5RNPY1R
SCHEMBL29349965	0.81	ACE (0.58)	—

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-2627662-B1	METHODS FOR PREPARING MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES	BRISTOL MYERS SQUIBB CO (US)	2015-09-16	—	—	EP	disclosed