SCHEMBL16615860

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

nearest known ligand 0.46

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	SRC	P12931	1/20	0.46

▸	STAT3	P40763	2/20	0.44

▸	SSTR2	P30874	1/20	0.43

▸	SSTR4	P31391	1/20	0.43

▸	SSTR5	P35346	1/20	0.43

▸	MC1R	Q01726	1/20	0.42

▸	KDM1A	O60341	1/20	0.41

▸	RCOR1	Q9UKL0	1/20	0.41

▸	MMP1	P03956	2/20	0.41

▸	MMP2	P08253	2/20	0.41

▸	MMP3	P08254	2/20	0.41

▸	MMP9	P14780	2/20	0.41

▸	MMP8	P22894	2/20	0.41

▸	NPY4R	P50391	3/20	0.40

▸	CCKBR	P32239	1/20	0.40

▸	POLB	P06746	1/20	0.40

▸	TDP1	Q9NUW8	1/20	0.40

▸	L3MBTL1	Q9Y468	1/20	0.40

▸	APLNR	P35414	1/20	0.40

▸	MLLT3	P42568	1/20	0.40

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
SCHEMBL16615904	0.95	SRC (0.48)	SRCSTAT3SSTR2SSTR4SSTR5
SCHEMBL16615915	0.91	SRC (0.47)	SRCSTAT3MC1RKDM1ARCOR1
SCHEMBL16691478	0.90	SRC (0.51)	SRCSTAT3SSTR2SSTR4SSTR5
SCHEMBL16691494	0.88	SRC (0.49)	SRCSTAT3SSTR2SSTR4SSTR5
SCHEMBL16691476	0.87	SRC (0.49)	SRCSTAT3SSTR2SSTR4SSTR5
SCHEMBL16691453	0.87	SRC (0.48)	SRCSTAT3SSTR2SSTR4SSTR5
SCHEMBL16691493	0.86	SRC (0.51)	SRCSTAT3SSTR2SSTR4SSTR5
SCHEMBL16615859	0.86	SRC (0.48)	SRCSTAT3SSTR2SSTR4SSTR5
SCHEMBL16691495	0.86	SRC (0.48)	SRCSTAT3SSTR2SSTR4SSTR5
SCHEMBL16691466	0.85	SRC (0.47)	SRCSTAT3SSTR2SSTR4SSTR5

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