SCHEMBL30712931

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)CNC(=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)CNC(=O)[C@@H](N)CCSC)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)O

nearest known ligand 0.63

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	CALCR	P30988	4/20	0.63

▸	CRHR1	P34998	1/20	0.60

▸	CRHR2	Q13324	1/20	0.60

▸	GLP1R	P43220	14/20	0.55

▸	CCKBR	P32239	1/20	0.54

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
SCHEMBL31182438	0.90	CALCR (0.68)	CALCRCRHR1CRHR2GLP1R
SCHEMBL30432434	0.89	CALCR (0.66)	CALCRCRHR1CRHR2GLP1RCCKBR
SCHEMBL30658361	0.88	CALCR (0.63)	CALCRCRHR1CRHR2GLP1R
SCHEMBL29410245	0.88	CALCR (0.59)	CALCRCRHR1CRHR2GLP1RCCKBR
SCHEMBL29967394	0.88	GLP1R (0.65)	CALCRCRHR1CRHR2GLP1R
SCHEMBL31182441	0.87	GLP1R (0.66)	CALCRCRHR1CRHR2GLP1RCCKBR
SCHEMBL29967663	0.87	GLP1R (0.64)	CALCRCRHR1CRHR2GLP1R
SCHEMBL31656529	0.86	CALCR (0.62)	CALCRCRHR1CRHR2GLP1RCCKBR
SCHEMBL30432359	0.86	CALCR (0.61)	CALCRCRHR1CRHR2GLP1RCCKBR
SCHEMBL29884536	0.86	CALCR (0.63)	CALCRCRHR1CRHR2GLP1R

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-20240003881-A1	SYSTEM AND METHOD FOR RAPID AND SENSITIVE DETECTION OF ANTI-PATHOGEN ANTIBODIES	THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA)	2024-01-04	—	—	US	disclosed