SCHEMBL10586963

CC(C)C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)CC(=O)Nc1cccc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	NMUR2	Q9GZQ4	5/20	0.57

▸	NMUR1	Q9HB89	5/20	0.57

▸	EPHA2	P29317	3/20	0.50

▸	OPRM1	P35372	5/20	0.49

▸	DRD1	P21728	1/20	0.49

▸	GNRHR	P30968	1/20	0.49

▸	MRGPRX2	Q96LB1	1/20	0.49

▸	ABCB11	O95342	1/20	0.48

▸	NPY4R	P50391	6/20	0.48

▸	NPY1R	P25929	4/20	0.48

▸	NPY2R	P49146	3/20	0.48

▸	NPY5R	Q15761	3/20	0.48

▸	OPRK1	P41145	4/20	0.47

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
SCHEMBL9728009	0.85	NMUR2 (0.53)	NMUR2NMUR1EPHA2OPRM1OPRK1
SCHEMBL9852750	0.84	NPY4R (0.58)	NMUR2NMUR1EPHA2OPRM1NPY4R
SCHEMBL9629910	0.84	NMUR2 (0.63)	NMUR2NMUR1EPHA2NPY4RNPY1R
SCHEMBL30293724	0.84	NPY4R (0.56)	NMUR2NMUR1EPHA2OPRM1DRD1
SCHEMBL9630682	0.83	NMUR2 (0.57)	NMUR2NMUR1EPHA2OPRM1DRD1
SCHEMBL9629930	0.83	NMUR2 (0.56)	NMUR2NMUR1EPHA2OPRM1DRD1
SCHEMBL9629866	0.82	NMUR2 (0.58)	NMUR2NMUR1EPHA2OPRM1DRD1
SCHEMBL9630723	0.82	NMUR2 (0.55)	NMUR2NMUR1EPHA2OPRM1DRD1
SCHEMBL29390426	0.81	OPRM1 (0.61)	NMUR2NMUR1EPHA2OPRM1DRD1
SCHEMBL10588690	0.81	NPY4R (0.61)	NMUR2NMUR1NPY4RNPY1RNPY2R

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-0328089-A2	Reduced size LHRH analogs	ABBOTT LABORATORIES (US)	1989-08-16	—	—	EP	disclosed