SCHEMBL30712879

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	13/20	0.62

▸	GCGR	P47871	1/20	0.62

▸	GIPR	P48546	1/20	0.62

▸	ECE1	P42892	1/20	0.61

▸	MUS81	Q96NY9	1/20	0.61

▸	CCKBR	P32239	1/20	0.60

▸	IL23R	Q5VWK5	5/20	0.60

▸	VIPR1	P32241	1/20	0.60

▸	NPY1R	P25929	1/20	0.58

▸	NPY2R	P49146	1/20	0.58

▸	NPY4R	P50391	1/20	0.58

▸	NPY5R	Q15761	1/20	0.58

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
SCHEMBL30712885	0.93	IL23R (0.63)	GLP1RGCGRGIPRECE1MUS81
SCHEMBL30906400	0.92	GLP1R (0.69)	GLP1RGCGRGIPRECE1MUS81
SCHEMBL7358806	0.90	IL23R (0.61)	GLP1RGCGRGIPRECE1MUS81
SCHEMBL30299227	0.90	GLP1R (0.68)	GLP1RGCGRGIPRECE1MUS81
SCHEMBL30093110	0.90	IL23R (0.60)	IL23R
SCHEMBL29555404	0.90	GLP1R (0.62)	GLP1RGCGRGIPRECE1MUS81
SCHEMBL30432072	0.89	GLP1R (0.66)	GLP1RECE1MUS81CCKBRIL23R
SCHEMBL29705113	0.89	GLP1R (0.68)	GLP1RGCGRGIPRECE1MUS81
SCHEMBL30431773	0.89	PTH1R (0.65)	GLP1RGCGRGIPRECE1MUS81
SCHEMBL29555214	0.89	GLP1R (0.63)	GLP1RGCGRGIPRECE1MUS81

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