SCHEMBL29442118

C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	EPHA2	P29317	2/20	0.57

▸	NPY4R	P50391	8/20	0.53

▸	NPY1R	P25929	6/20	0.53

▸	NPY5R	Q15761	5/20	0.53

▸	NPY2R	P49146	2/20	0.53

▸	OPRM1	P35372	7/20	0.51

▸	OPRD1	P41143	1/20	0.51

▸	OPRK1	P41145	6/20	0.49

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
SCHEMBL29442113	0.88	EPHA2 (0.58)	EPHA2NPY4RNPY1RNPY5RNPY2R
SCHEMBL29442102	0.87	EPHA2 (0.58)	EPHA2NPY4RNPY1RNPY5RNPY2R
SCHEMBL5499951	0.87	NPY4R (0.58)	NPY4RNPY1RNPY5RNPY2R
SCHEMBL29619531	0.85	NPY4R (0.58)	NPY4RNPY1RNPY5RNPY2ROPRM1
SCHEMBL10588690	0.85	NPY4R (0.61)	NPY4RNPY1RNPY5RNPY2R
SCHEMBL30597842	0.85	OPRM1 (0.52)	EPHA2OPRM1OPRD1
SCHEMBL30943512	0.84	NTSR2 (0.56)	NPY4RNPY1RNPY5RNPY2ROPRM1
SCHEMBL30392298	0.84	OPRM1 (0.56)	OPRM1OPRD1OPRK1
SCHEMBL29868580	0.84	OPRM1 (0.59)	EPHA2OPRM1OPRD1OPRK1
SCHEMBL31676699	0.84	OPRM1 (0.57)	OPRM1OPRD1

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-20220096656-A1	NANOCARRIERS HAVING SURFACE CONJUGATED PEPTIDES AND USES THEREOF FOR SUSTAINED LOCAL RELEASE OF DRUGS	NORTHWESTERN UNIVERSITY	2022-03-31	—	—	US	disclosed