SCHEMBL31399744

CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	4/20	0.51

▸	CXCR4	P61073	3/20	0.51

▸	C5AR1	P21730	1/20	0.51

▸	GLP1R	P43220	8/20	0.49

▸	GHSR	Q92847	2/20	0.49

▸	NPY2R	P49146	1/20	0.49

▸	GCGR	P47871	1/20	0.48

▸	NPBWR1	P48145	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
SCHEMBL31399734	0.99	IL23R (0.51)	IL23RCXCR4C5AR1GLP1RGHSR
SCHEMBL31399727	0.97	CXCR4 (0.53)	IL23RCXCR4GLP1RGCGRNPBWR1
SCHEMBL31454223	0.94	C5AR1 (0.54)	CXCR4C5AR1GLP1RGHSRNPY2R
SCHEMBL31473234	0.92	NPBWR1 (0.53)	CXCR4C5AR1GLP1RGHSRNPY2R
SCHEMBL31473233	0.92	NPBWR1 (0.53)	CXCR4C5AR1GLP1RGHSRNPY2R
SCHEMBL30590790	0.90	ECE1 (0.53)	GHSR
SCHEMBL29754547	0.90	C5AR1 (0.55)	C5AR1GHSR
SCHEMBL31454225	0.90	GLP1R (0.56)	GLP1RGHSRNPY2RGCGR
SCHEMBL30860218	0.90	PTH1R (0.59)	IL23RGLP1RGHSRNPY2RGCGR
SCHEMBL29461990	0.89	C5AR1 (0.54)	CXCR4C5AR1GLP1RGHSRNPY2R

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
CN-119771358-A	Magnetic composite adsorbent for blood perfusion and preparation method and application thereof	重庆希尔康血液净化器材研发有限公司	2025-04-08	—	—	CN	disclosed