SCHEMBL29408675

CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O

nearest known ligand 0.74

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	CCKBR	P32239	16/20	0.74

▸	CCKAR	P32238	2/20	0.66

▸	GRPR	P30550	1/20	0.60

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
SCHEMBL29702143	0.98	CCKBR (0.74)	CCKBRCCKARGRPR
SCHEMBL29408672	0.93	CCKBR (0.83)	CCKBRCCKAR
SCHEMBL29709573	0.93	CCKBR (0.83)	CCKBRCCKAR
SCHEMBL30816027	0.93	CCKBR (0.83)	CCKBRCCKAR
SCHEMBL31236196	0.93	CCKBR (0.83)	CCKBRCCKAR
SCHEMBL29408680	0.92	CCKBR (0.82)	CCKBRCCKAR
SCHEMBL31015828	0.91	CCKBR (0.82)	CCKBRCCKAR
SCHEMBL31378333	0.91	CCKBR (0.82)	CCKBRCCKAR
SCHEMBL29414551	0.91	CCKBR (0.74)	CCKBRCCKAR
SCHEMBL31015850	0.91	CCKBR (0.83)	CCKBRCCKAR

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-114126654-A	Para-aminohippuric acid (PAH) as a kidney protective substance	同位素技术慕尼黑有限公司	2022-03-01	—	—	CN	disclosed