SCHEMBL30317539

C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	KISS1R	Q969F8	7/20	0.55

▸	CTSL	P07711	3/20	0.54

▸	CTSS	P25774	3/20	0.54

▸	CTSK	P43235	3/20	0.54

▸	CTSH	P09668	1/20	0.54

▸	IL23R	Q5VWK5	2/20	0.51

▸	TACR1	P25103	1/20	0.50

▸	CXCR4	P61073	2/20	0.50

▸	C5AR1	P21730	1/20	0.49

▸	OPRD1	P41143	1/20	0.48

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
SCHEMBL29883115	0.89	C5AR1 (0.59)	CTSLCTSSCTSKCTSHIL23R
SCHEMBL30608431	0.87	KISS1R (0.61)	KISS1RCTSLCTSSCTSKCTSH
SCHEMBL31238548	0.87	KISS1R (0.62)	KISS1RCTSLCTSSCTSKCTSH
SCHEMBL31029901	0.87	CXCR4 (0.54)	KISS1RCTSLCTSSCTSKCTSH
SCHEMBL8937035	0.86	CXCR4 (0.56)	KISS1RCTSLCTSSCTSKCTSH
SCHEMBL29476405	0.86	KISS1R (0.55)	KISS1RCTSLCTSSCTSKCTSH
SCHEMBL29476509	0.86	KISS1R (0.55)	KISS1RCTSLCTSSCTSKCTSH
SCHEMBL38662279	0.86	KISS1R (0.58)	KISS1RCXCR4C5AR1
SCHEMBL29678002	0.86	ACE (0.53)	OPRD1
SCHEMBL30258020	0.85	CXCL8 (0.56)	KISS1RCTSLCTSSCTSKCTSH

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-110003336-B	PD-1 single domain antibody, nucleotide sequence and kit	深圳普瑞金生物药业股份有限公司	2023-05-12	—	—	CN	disclosed
CN-109970858-B	CD22 single domain antibody, nucleotide sequence and kit	深圳普瑞金生物药业股份有限公司	2023-05-09	—	—	CN	disclosed