SCHEMBL16628210

CNC(=O)CCCCCNC(=O)CN(CC(=O)NCCO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)CC(=O)NCCO[C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O

nearest known ligand 0.48

Predicted protein targets (top 18)

	gene	UniProt	supporting neighbours	confidence
▸	MMP13	P45452	1/20	0.48

▸	CD209	Q9NNX6	2/20	0.45

▸	FGF1	P05230	2/20	0.44

▸	FGF2	P09038	2/20	0.44

▸	VEGFA	P15692	2/20	0.44

▸	HPSE	Q9Y251	2/20	0.44

▸	GJB2	P29033	1/20	0.40

▸	LGALS8	O00214	2/20	0.40

▸	LGALS3	P17931	2/20	0.40

▸	LGALS4	P56470	2/20	0.40

▸	ENGASE	Q8NFI3	1/20	0.40

▸	MDK	P21741	1/20	0.38

▸	IGF2R	P11717	1/20	0.37

▸	PRKCA	P17252	1/20	0.37

▸	KDM4E	B2RXH2	1/20	0.36

▸	POLB	P06746	1/20	0.36

▸	SMN1; SMN2	Q16637	1/20	0.36

▸	SELP	P16109	1/20	0.36

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
SCHEMBL23316916	1.00	MMP13 (0.48)	MMP13CD209FGF1FGF2VEGFA
SCHEMBL18051731	0.96	MMP13 (0.47)	MMP13CD209FGF1FGF2VEGFA
SCHEMBL19860816	0.96	MMP13 (0.46)	MMP13CD209FGF1FGF2VEGFA
SCHEMBL16628168	0.96	MMP13 (0.46)	MMP13CD209FGF1FGF2VEGFA
SCHEMBL16628231	0.95	MMP13 (0.47)	MMP13CD209FGF1FGF2VEGFA
SCHEMBL18164223	0.94	MMP13 (0.46)	MMP13CD209FGF1FGF2VEGFA
SCHEMBL16640875	0.93	MMP13 (0.49)	MMP13CD209FGF1FGF2VEGFA
SCHEMBL18053495	0.93	MMP13 (0.49)	MMP13CD209FGF1FGF2VEGFA
SCHEMBL16640824	0.93	MMP13 (0.49)	MMP13CD209FGF1FGF2VEGFA
SCHEMBL16509386	0.93	MMP13 (0.49)	MMP13CD209FGF1FGF2VEGFA

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-2015051052-A2	GLUCOSE-RESPONSIVE INSULIN CONJUGATES	MERCK SHARP & DOHME CORP. (US)	2015-04-09	—	—	WO	disclosed