SCHEMBL16615890

CC(O)[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@H](CN[C@@H](CO)C(=O)N[C@@H](Cc2ccccc2)C(=O)O)CCCCNC(=O)CC[C@H](NC(=O)[C@@H](N)CO)C(=O)N1N

nearest known ligand 0.40

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	SRC	P12931	3/20	0.39

▸	OPRM1	P35372	2/20	0.38

▸	OPRD1	P41143	2/20	0.38

▸	OPRK1	P41145	2/20	0.38

▸	SSTR1	P30872	4/20	0.37

▸	SSTR3	P32745	1/20	0.37

▸	REN	P00797	3/20	0.36

▸	MC1R	Q01726	1/20	0.36

▸	CPB2	Q96IY4	1/20	0.35

▸	BIRC3	Q13489	1/20	0.35

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
SCHEMBL16615888	0.90	MC1R (0.38)	SRCOPRM1OPRD1OPRK1SSTR1
SCHEMBL16615857	0.90	SSTR1 (0.43)	SRCOPRM1OPRD1OPRK1SSTR1
SCHEMBL16615891	0.88	SSTR1 (0.36)	SRCOPRM1OPRD1OPRK1SSTR1
SCHEMBL16615884	0.86	SSTR1 (0.43)	SRCOPRM1OPRD1OPRK1SSTR1
SCHEMBL16615885	0.83	SSTR1 (0.37)	OPRM1OPRD1OPRK1SSTR1SSTR3
SCHEMBL16615743	0.81	TERF2 (0.42)	SRCOPRM1OPRD1OPRK1SSTR1
SCHEMBL16615868	0.80	MC1R (0.45)	SRCOPRM1OPRD1OPRK1SSTR1
SCHEMBL16615750	0.78	SRC (0.47)	SRCOPRM1OPRD1OPRK1MC1R
SCHEMBL16615764	0.78	MC1R (0.46)	SRCOPRM1OPRD1OPRK1SSTR1
SCHEMBL16615854	0.76	SSTR2 (0.50)	SRCOPRM1OPRD1OPRK1SSTR1

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