SCHEMBL30844089

CC(C)C[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.64

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	KISS1R	Q969F8	5/20	0.64

▸	CXCL8	P10145	10/20	0.58

▸	OPRM1	P35372	1/20	0.55

▸	CCKBR	P32239	1/20	0.55

▸	SLC6A2	P23975	1/20	0.54

▸	TACR1	P25103	1/20	0.54

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
SCHEMBL30648460	0.96	KISS1R (0.64)	KISS1RCXCL8
SCHEMBL38661114	0.93	KISS1R (0.62)	KISS1RCXCL8OPRM1CCKBR
SCHEMBL31020744	0.92	SLC6A2 (0.63)	KISS1ROPRM1SLC6A2
SCHEMBL10599958	0.90	DPP3 (0.57)	KISS1RCXCL8OPRM1CCKBRTACR1
SCHEMBL10599944	0.90	DPP3 (0.57)	KISS1RCXCL8OPRM1CCKBRTACR1
Spinorphin SCHEMBL25273730	0.89	KISS1R (0.60)	KISS1ROPRM1SLC6A2
Spinorphin SCHEMBL29977609	0.89	KISS1R (0.60)	KISS1ROPRM1SLC6A2
Spinorphin SCHEMBL25217672	0.89	KISS1R (0.60)	KISS1ROPRM1SLC6A2
SCHEMBL29598567	0.87	KISS1R (0.65)	KISS1RTACR1
SCHEMBL30392074	0.87	KISS1R (0.58)	KISS1ROPRM1SLC6A2

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
CN-117820469-A	anti-Slc 17a2 monoclonal antibody and application thereof	中国人民解放军空军军医大学	2024-04-05	—	—	CN	claimed
CN-117820469-A	anti-Slc 17a2 monoclonal antibody and application thereof	中国人民解放军空军军医大学	2024-04-05	—	—	CN	disclosed