SCHEMBL30824293

CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	4/20	0.59

▸	CRHR1	P34998	1/20	0.54

▸	CRHR2	Q13324	1/20	0.54

▸	HCRTR1	O43613	1/20	0.54

▸	HCRTR2	O43614	1/20	0.54

▸	GLP1R	P43220	11/20	0.53

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
SCHEMBL29836317	0.93	CALCR (0.53)	CALCRCRHR1CRHR2HCRTR1HCRTR2
SCHEMBL29836277	0.93	CALCR (0.53)	CALCRCRHR1CRHR2HCRTR1HCRTR2
SCHEMBL29827711	0.91	CRHR1 (0.55)	CALCRCRHR1CRHR2HCRTR1HCRTR2
SCHEMBL30168740	0.91	CALCR (0.54)	CALCRCRHR1CRHR2HCRTR1HCRTR2
SCHEMBL30168714	0.91	CALCR (0.54)	CALCRCRHR1CRHR2HCRTR1HCRTR2
SCHEMBL29836375	0.90	CALCR (0.50)	CALCRCRHR1CRHR2HCRTR1HCRTR2
SCHEMBL29836368	0.90	CALCR (0.50)	CALCRCRHR1CRHR2HCRTR1HCRTR2
SCHEMBL29903350	0.90	CALCR (0.63)	CALCRCRHR1CRHR2HCRTR1HCRTR2
SCHEMBL29625325	0.89	CALCR (0.55)	CALCRCRHR1CRHR2GLP1R
SCHEMBL30168779	0.88	CALCR (0.51)	CALCRCRHR1CRHR2HCRTR1HCRTR2

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
US-11925667-B2	Engineered therapeutic probiotic system and method	CHANG MATTHEW WOOK (SG)	2024-03-12	—	—	US	disclosed