SCHEMBL29556572

CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(N)=O)[C@@H](C)CC)[C@@H](C)CC

nearest known ligand 0.67

Predicted protein targets (top 2)

	gene	UniProt	supporting neighbours	confidence
▸	NPBWR1	P48145	8/20	0.67

▸	IL23R	Q5VWK5	11/20	0.64

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
SCHEMBL29554941	1.00	NPBWR1 (0.67)	NPBWR1IL23R
SCHEMBL29555137	0.94	GHSR (0.62)	NPBWR1IL23R
SCHEMBL29555419	0.92	IL23R (0.70)	NPBWR1IL23R
SCHEMBL31105460	0.90	IL23R (0.66)	NPBWR1IL23R
SCHEMBL29555526	0.90	NPBWR1 (0.64)	NPBWR1
SCHEMBL29555471	0.90	NPBWR1 (0.64)	NPBWR1
SCHEMBL29555581	0.89	NPBWR1 (0.67)	NPBWR1
SCHEMBL26080247	0.88	GLP1R (0.65)	NPBWR1IL23R
SCHEMBL26080293	0.88	NPBWR1 (0.67)	NPBWR1
SCHEMBL30518077	0.87	IL23R (0.64)	NPBWR1IL23R

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-112654634-B	Synthetic peptides, prodrugs, pharmaceutical compositions and uses	生物医药产品开发公司	2022-05-27	—	—	CN	disclosed