SCHEMBL19787869

CC(C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C

nearest known ligand 0.69

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	DPP3	Q9NY33	5/20	0.69

▸	OPRM1	P35372	2/20	0.58

▸	CAPN1	P07384	2/20	0.57

▸	CTSB	P07858	2/20	0.57

▸	REN	P00797	2/20	0.56

▸	SLC6A2	P23975	1/20	0.56

▸	ANPEP	P15144	1/20	0.56

▸	LNPEP	Q9UIQ6	1/20	0.56

▸	C5AR1	P21730	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
SCHEMBL29804127	0.95	DPP3 (0.73)	DPP3OPRM1RENSLC6A2ANPEP
SCHEMBL31071616	0.95	DPP3 (0.73)	DPP3OPRM1RENSLC6A2ANPEP
SCHEMBL31090175	0.93	DPP3 (0.77)	DPP3OPRM1SLC6A2ANPEPLNPEP
SCHEMBL30953538	0.91	DPP3 (0.62)	DPP3OPRM1RENSLC6A2C5AR1
SCHEMBL30023454	0.89	DPP3 (0.64)	DPP3OPRM1CAPN1CTSBSLC6A2
SCHEMBL30392261	0.88	DPP3 (0.61)	DPP3OPRM1CAPN1CTSBSLC6A2
SCHEMBL31402672	0.88	KISS1R (0.63)	DPP3OPRM1RENSLC6A2
SCHEMBL29993706	0.88	DPP3 (0.68)	DPP3RENSLC6A2
SCHEMBL30626308	0.88	OPRM1 (0.62)	DPP3OPRM1SLC6A2
SCHEMBL20749886	0.88	OPRM1 (0.63)	DPP3OPRM1SLC6A2

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-9872918-B2	Hydroxyl-polymer-drug-protein conjugates	MERSANA THERAPEUTICS, INC. (US)	2018-01-23	—	—	US	disclosed