SCHEMBL30712898

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

nearest known ligand 0.65

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	PTH1R	Q03431	9/20	0.64

▸	GLP1R	P43220	9/20	0.62

▸	CCKBR	P32239	1/20	0.62

▸	GCGR	P47871	4/20	0.61

▸	GIPR	P48546	1/20	0.61

▸	C5AR1	P21730	1/20	0.61

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
SCHEMBL31473045	0.93	PTH1R (0.73)	PTH1RGLP1RCCKBRGCGR
SCHEMBL30763299	0.92	PTH1R (0.73)	PTH1RGLP1RCCKBRGCGR
SCHEMBL29407365	0.91	PTH1R (0.68)	PTH1RGLP1RCCKBRGCGRGIPR
SCHEMBL30466631	0.91	PTH1R (0.68)	PTH1RGLP1RGCGR
SCHEMBL31182447	0.91	PTH1R (0.73)	PTH1RGLP1RCCKBR
SCHEMBL30380786	0.90	PTH1R (0.60)	PTH1RGLP1RCCKBRGCGRGIPR
SCHEMBL30773531	0.90	PTH1R (0.69)	PTH1RGLP1RCCKBRGCGRGIPR
SCHEMBL31000904	0.90	GLP1R (0.69)	GLP1RCCKBRGCGRGIPR
Teriparatide SCHEMBL30448707	0.90	PTH1R (0.80)	PTH1RGLP1RCCKBR
Teriparatide SCHEMBL30645329	0.90	PTH1R (0.80)	PTH1RGLP1RCCKBR

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