SCHEMBL31068602

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CO)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(N)=O)C(C)C

nearest known ligand 0.73

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	4/20	0.73

▸	CRHR1	P34998	1/20	0.70

▸	CRHR2	Q13324	1/20	0.70

▸	GLP1R	P43220	12/20	0.64

▸	GCGR	P47871	8/20	0.64

▸	GIPR	P48546	5/20	0.64

▸	KEAP1	Q14145	1/20	0.64

▸	CCKBR	P32239	4/20	0.62

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
Corticorelin Acetate SCHEMBL29357284	0.91	CRHR1 (0.72)	CALCRCRHR1CRHR2GLP1RGCGR
SCHEMBL31139952	0.91	CALCR (0.76)	CALCRCRHR1CRHR2GLP1RGCGR
SCHEMBL30658226	0.91	CALCR (0.77)	CALCRCRHR1CRHR2GLP1RGCGR
SCHEMBL31168252	0.90	CALCR (0.73)	CALCRCRHR1CRHR2GLP1RGCGR
SCHEMBL30495780	0.90	CALCR (0.73)	CALCRCRHR1CRHR2GLP1RKEAP1
SCHEMBL31182769	0.89	CALCR (0.65)	CALCRCRHR1CRHR2GLP1RGCGR
SCHEMBL30437180	0.89	CALCR (0.68)	CALCRGLP1RCCKBR
SCHEMBL31139995	0.89	GLP1R (0.76)	CALCRGLP1RGCGRGIPRCCKBR
SCHEMBL29624204	0.89	CALCR (0.76)	CALCRCRHR1CRHR2GLP1RGCGR
SCHEMBL29413135	0.89	CALCR (0.76)	CALCRCRHR1CRHR2GLP1RGCGR

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-118510523-A	Peptide nucleic acid degradation complex and use thereof	维里蒂斯有限责任公司	2024-08-16	—	—	CN	disclosed