SCHEMBL16615762

CN[C@@H](CO)C(=O)N(N)[C@H]1CCC(=O)NCCCC[C@@H](C(=O)N(C)[C@@H](CO)C(=O)N[C@@H](Cc2ccccc2)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](C(C)O)NC1=O

nearest known ligand 0.43

Predicted protein targets (top 19)

	gene	UniProt	supporting neighbours	confidence
▸	SRC	P12931	1/20	0.43

▸	MMP1	P03956	4/20	0.38

▸	MMP2	P08253	4/20	0.38

▸	MMP3	P08254	4/20	0.38

▸	MMP9	P14780	4/20	0.38

▸	MMP8	P22894	4/20	0.38

▸	SSTR1	P30872	6/20	0.36

▸	SSTR3	P32745	1/20	0.36

▸	SSTR2	P30874	1/20	0.36

▸	SSTR4	P31391	1/20	0.36

▸	SSTR5	P35346	1/20	0.36

▸	KLK7	P49862	2/20	0.34

▸	TERF2	Q15554	2/20	0.34

▸	NTSR2	O95665	1/20	0.34

▸	BIRC3	Q13489	1/20	0.34

▸	NPY1R	P25929	1/20	0.34

▸	NPY2R	P49146	1/20	0.34

▸	NPY4R	P50391	1/20	0.34

▸	NPY5R	Q15761	1/20	0.34

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
SCHEMBL16615917	0.82	TERF2 (0.41)	SRCMMP1MMP2MMP3MMP9
SCHEMBL16615886	0.81	SRC (0.40)	SRCMMP1MMP2MMP3MMP9
SCHEMBL16615743	0.79	TERF2 (0.42)	SRCSSTR1SSTR3SSTR2SSTR4
SCHEMBL16615904	0.75	SRC (0.48)	SRCMMP1MMP2MMP3MMP9
SCHEMBL16691478	0.74	SRC (0.51)	SRCMMP1MMP2MMP3MMP9
SCHEMBL16615750	0.74	SRC (0.47)	SRCMMP1MMP2MMP3MMP9
SCHEMBL16691453	0.73	SRC (0.48)	SRCMMP1MMP2MMP3MMP9
SCHEMBL16615751	0.73	SSTR5 (0.47)	SRCSSTR1SSTR3SSTR2SSTR4
SCHEMBL16691476	0.73	SRC (0.49)	SRCMMP1MMP2MMP3MMP9
SCHEMBL16615860	0.72	SRC (0.46)	SRCMMP1MMP2MMP3MMP9

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-2015044900-A1	THERAPEUTIC IMMUNOMODULATING COMPOUNDS	AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN)	2015-04-02	—	—	WO	disclosed