SCHEMBL13356182

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(N)=O)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.49

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	13/20	0.49

▸	SCTR	P47872	1/20	0.49

▸	APLNR	P35414	2/20	0.47

▸	GCGR	P47871	2/20	0.46

▸	GIPR	P48546	1/20	0.45

▸	RAMP3	O60896	1/20	0.45

▸	CALCR	P30988	1/20	0.45

▸	IL23R	Q5VWK5	1/20	0.44

▸	NPY1R	P25929	1/20	0.44

▸	NPY2R	P49146	1/20	0.44

▸	NPY4R	P50391	1/20	0.44

▸	NPY5R	Q15761	1/20	0.44

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
SCHEMBL13356183	0.96	GLP1R (0.48)	GLP1RSCTRAPLNRGCGRGIPR
SCHEMBL16508473	0.89	NPY5R (0.45)	GLP1RSCTRAPLNRGCGRIL23R
SCHEMBL16508489	0.89	NPY4R (0.47)	GLP1RSCTRAPLNRIL23RNPY1R
SCHEMBL16508481	0.88	TLR2 (0.52)	GLP1RGCGRGIPRIL23RNPY1R
SCHEMBL16507848	0.87	APLNR (0.50)	GLP1RSCTRAPLNRGCGRGIPR
SCHEMBL16508496	0.87	NPY4R (0.45)	GLP1RSCTRAPLNRIL23RNPY1R
SCHEMBL16508438	0.86	NPY4R (0.54)	GLP1RSCTRAPLNRNPY1RNPY2R
SCHEMBL16508537	0.86	NPY4R (0.49)	APLNRNPY1RNPY2RNPY4RNPY5R
SCHEMBL13356170	0.85	TLR2 (0.48)	GLP1RGCGRGIPRIL23RNPY1R
SCHEMBL16508437	0.85	NPY4R (0.46)	GLP1RAPLNRNPY1RNPY2RNPY4R

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
WO-2010053547-A2	CXCR5 RECEPTOR COMPOUNDS	ANCHOR THERAPEUTICS, INC. (US)	2010-05-14	—	—	WO	disclosed