SCHEMBL16480282

CC(C)C[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]2CC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc3ccccc3)C(C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N2)CCCCNC(=O)C[C@@H](C(N)=O)NC1=O

nearest known ligand 0.66

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	TERF2IP	Q9NYB0	12/20	0.50

▸	NPY1R	P25929	2/20	0.48

▸	NPY2R	P49146	2/20	0.48

▸	NPY4R	P50391	2/20	0.48

▸	NPY5R	Q15761	2/20	0.48

▸	BECN1	Q14457	3/20	0.47

▸	MLLT3	P42568	1/20	0.46

▸	F11	P03951	1/20	0.46

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
SCHEMBL16480284	0.95	TERF2IP (0.49)	TERF2IPNPY1RNPY2RNPY4RNPY5R
SCHEMBL14028885	0.93	TERF2IP (0.45)	TERF2IPNPY1RNPY2RNPY4RNPY5R
SCHEMBL14028880	0.88	TERF2IP (0.46)	TERF2IPNPY1RNPY2RNPY4RNPY5R
SCHEMBL14028877	0.88	BECN1 (0.44)	TERF2IPNPY1RNPY2RNPY4RNPY5R
SCHEMBL16480283	0.86	SIRT2 (0.45)	TERF2IPNPY1RNPY2RNPY4RNPY5R
SCHEMBL10138953	0.81	NPY1R (0.41)	TERF2IPNPY1RNPY2RNPY4RNPY5R
SCHEMBL10138947	0.74	NPY1R (0.39)	TERF2IPNPY1RNPY2RNPY4RNPY5R
SCHEMBL23351287	0.74	NPY1R (0.53)	NPY1RNPY2RNPY4RNPY5RBECN1
SCHEMBL10138943	0.72	SIRT2 (0.42)	NPY1RNPY2RNPY4RNPY5R
SCHEMBL31060618	0.72	TERF2IP (0.51)	TERF2IP

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
US-8629241-B2	Alpha helical mimics, their uses and methods for their production	THE UNIVERSITY OF QUEENSLAND (AU)	2014-01-14	—	—	US	disclosed