SCHEMBL9843511

CC(C)C[C@H](NC(=O)[C@H](N)COC(C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)C(C(=O)[C@H](C)N)(C(=O)N(C)C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)c1cccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	NMUR2	Q9GZQ4	7/20	0.46

▸	NMUR1	Q9HB89	7/20	0.46

▸	EPHA2	P29317	4/20	0.42

▸	NPY4R	P50391	4/20	0.42

▸	NPY1R	P25929	3/20	0.42

▸	NPY2R	P49146	2/20	0.42

▸	NPY5R	Q15761	2/20	0.42

▸	OPRM1	P35372	5/20	0.42

▸	OPRK1	P41145	5/20	0.42

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
SCHEMBL9632114	0.83	NMUR2 (0.46)	NMUR2NMUR1EPHA2NPY4RNPY1R
SCHEMBL29510980	0.82	NPY4R (0.55)	NMUR2NMUR1EPHA2NPY4RNPY1R
SCHEMBL9629967	0.78	NPY4R (0.44)	NMUR2NMUR1EPHA2NPY4RNPY1R
SCHEMBL29813882	0.75	OPRK1 (0.44)	NMUR2NMUR1NPY4RNPY1RNPY2R
SCHEMBL22288702	0.74	KISS1R (0.57)	—
SCHEMBL22288705	0.74	KISS1R (0.57)	—
SCHEMBL34464914	0.74	GNRHR (0.60)	—
SCHEMBL10586963	0.74	NMUR2 (0.57)	NMUR2NMUR1EPHA2NPY4RNPY1R
SCHEMBL9630914	0.73	NMUR2 (0.53)	NMUR2NMUR1NPY4RNPY1RNPY2R
Hydrochloric Acid SCHEMBL11665303	0.73	NMUR2 (0.58)	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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0413209-A1	LHRH analogs	TAP Pharmaceuticals Inc. (US)	1991-02-20	—	—	EP	disclosed
EP-0328090-A2	LHRH analogs	ABBOTT LABORATORIES (US)	1989-08-16	—	—	EP	disclosed