SCHEMBL9645050

CC(=O)OC[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N(C(=O)[C@H](N)Cc1cccc2ccccc12)[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NNC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	NMUR2	Q9GZQ4	7/20	0.47

▸	NMUR1	Q9HB89	7/20	0.47

▸	KISS1R	Q969F8	1/20	0.44

▸	OPRD1	P41143	4/20	0.44

▸	EPHA2	P29317	2/20	0.44

▸	OPRM1	P35372	5/20	0.44

▸	CCKBR	P32239	1/20	0.43

▸	OPRK1	P41145	4/20	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
SCHEMBL10701549	0.93	NMUR2 (0.53)	NMUR2NMUR1OPRM1OPRK1
SCHEMBL10774369	0.81	NMUR2 (0.58)	NMUR2NMUR1OPRM1OPRK1
SCHEMBL9353686	0.79	KISS1R (0.55)	NMUR2NMUR1KISS1RCCKBR
Hydrochloric Acid SCHEMBL11665303	0.79	NMUR2 (0.58)	NMUR2NMUR1KISS1ROPRD1OPRM1
Acetic Acid SCHEMBL10702036	0.77	OPRM1 (0.44)	NMUR2NMUR1OPRM1OPRK1
SCHEMBL9632114	0.75	NMUR2 (0.46)	NMUR2NMUR1KISS1REPHA2OPRM1
SCHEMBL5499951	0.75	NPY4R (0.58)	NMUR2NMUR1
SCHEMBL30943512	0.74	NTSR2 (0.56)	NMUR2NMUR1OPRD1OPRM1
SCHEMBL22288702	0.74	KISS1R (0.57)	KISS1R
SCHEMBL22288705	0.74	KISS1R (0.57)	KISS1R

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-0293632-B1	DELIVERY SYSTEMS FOR THE CONTROLLED ADMINISTRATION OF LHRH ANALOGS	SYNTEX (U.S.A.) INC. (US)	1992-10-07	—	—	EP	disclosed