SCHEMBL30609012

C[C@@H](O)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(N)=O)[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	C5AR1	P21730	2/20	0.61

▸	CTSL	P07711	3/20	0.59

▸	CTSS	P25774	3/20	0.59

▸	CTSK	P43235	3/20	0.59

▸	CTSH	P09668	1/20	0.59

▸	CXCR4	P61073	8/20	0.58

▸	IL23R	Q5VWK5	1/20	0.54

▸	CAPN1	P07384	2/20	0.53

▸	CTSB	P07858	2/20	0.53

▸	MC4R	P32245	2/20	0.51

▸	MC5R	P33032	2/20	0.51

▸	MC3R	P41968	2/20	0.51

▸	MC1R	Q01726	2/20	0.51

▸	KISS1R	Q969F8	2/20	0.50

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
SCHEMBL30609008	1.00	C5AR1 (0.61)	C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30577311	0.97	CTSL (0.61)	C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30577312	0.96	C5AR1 (0.63)	C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30609002	0.95	CTSL (0.64)	C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30609006	0.95	CTSL (0.64)	C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30608996	0.95	CAPN1 (0.58)	C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30609005	0.94	CTSL (0.61)	C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30609010	0.93	CTSL (0.60)	C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30609016	0.93	CTSL (0.60)	C5AR1CTSLCTSSCTSKCTSH
SCHEMBL30609007	0.92	CTSL (0.64)	C5AR1CTSLCTSSCTSKCTSH

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
WO-2023169550-A1	POLYPEPTIDE COMPOUND FOR PREVENTING AND/OR TREATING RENAL FIBROSIS	中山大学	2023-09-14	—	—	WO	claimed
WO-2023169550-A1	POLYPEPTIDE COMPOUND FOR PREVENTING AND/OR TREATING RENAL FIBROSIS	中山大学	2023-09-14	—	—	WO	disclosed