SCHEMBL18569179

CC(=O)[C@H](CCCCNC(=O)C(N)CCCCNC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CCC(NC(=O)CCCCCCCCCCOc1ccc(C(=O)O)cc1)C(=O)O)NS

nearest known ligand 0.41

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	NOD1	Q9Y239	1/20	0.41

▸	GLP1R	P43220	8/20	0.40

▸	CD40	P25942	2/20	0.40

▸	OPRM1	P35372	1/20	0.39

▸	OPRD1	P41143	1/20	0.39

▸	OPRK1	P41145	1/20	0.39

▸	FOLH1	Q04609	3/20	0.39

▸	FNTA	P49354	2/20	0.38

▸	FNTB	P49356	2/20	0.38

▸	NMT2	O60551	1/20	0.38

▸	NMT1	P30419	1/20	0.38

▸	TLR2	O60603	1/20	0.38

▸	PRMT1	Q99873	1/20	0.38

▸	PGGT1B	P53609	1/20	0.37

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
SCHEMBL18569339	1.00	NOD1 (0.41)	NOD1GLP1RCD40OPRM1OPRD1
SCHEMBL16156105	0.87	GLP1R (0.41)	GLP1RFOLH1NMT2NMT1
SCHEMBL7002282	0.86	NOD1 (0.48)	NOD1GLP1RFOLH1FNTAFNTB
SCHEMBL16156099	0.86	ITGB3 (0.44)	NOD1NMT2NMT1
SCHEMBL16156152	0.86	ITGB3 (0.44)	NOD1NMT2NMT1
SCHEMBL16156159	0.86	ITGB3 (0.44)	NOD1NMT2NMT1
SCHEMBL14786059	0.85	FOLH1 (0.39)	GLP1RCD40FOLH1NMT2NMT1
SCHEMBL16146691	0.85	FOLH1 (0.41)	GLP1RCD40FOLH1NMT2NMT1
SCHEMBL16146684	0.85	FOLH1 (0.39)	GLP1RCD40FOLH1NMT2NMT1
SCHEMBL14786276	0.85	FOLH1 (0.39)	GLP1RCD40FOLH1NMT2NMT1

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
EP-2753642-B1	GLP-1 DERIVATIVES	NOVO NORDISK AS (DK)	2017-03-01	—	—	EP	disclosed