SCHEMBL9437217

CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	VIPR2	P41587	6/20	0.61

▸	VIPR1	P32241	4/20	0.60

▸	BACE1	P56817	2/20	0.59

▸	BACE2	Q9Y5Z0	2/20	0.59

▸	NPY4R	P50391	8/20	0.59

▸	NPY5R	Q15761	7/20	0.59

▸	NPY1R	P25929	6/20	0.59

▸	NPY2R	P49146	4/20	0.59

▸	ECE1	P42892	1/20	0.54

▸	GLP1R	P43220	1/20	0.54

▸	MUS81	Q96NY9	1/20	0.54

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
SCHEMBL9437230	0.96	VIPR2 (0.64)	VIPR2VIPR1BACE1BACE2NPY4R
SCHEMBL8827301	0.94	NPY4R (0.61)	VIPR2VIPR1BACE1BACE2NPY4R
SCHEMBL30929947	0.92	VIPR2 (0.68)	VIPR2VIPR1NPY4RNPY5RNPY1R
SCHEMBL29359930	0.91	VIPR2 (0.63)	VIPR2VIPR1BACE1BACE2NPY4R
SCHEMBL32681425	0.90	VIPR1 (0.71)	VIPR2VIPR1ECE1GLP1RMUS81
SCHEMBL29405269	0.90	VIPR1 (0.71)	VIPR2VIPR1ECE1GLP1RMUS81
SCHEMBL8827187	0.90	VIPR2 (0.60)	VIPR2VIPR1BACE1BACE2NPY4R
SCHEMBL9437247	0.90	BACE1 (0.61)	VIPR2VIPR1BACE1BACE2
SCHEMBL9437208	0.90	BACE1 (0.61)	VIPR2VIPR1BACE1BACE2
SCHEMBL9437222	0.90	BACE1 (0.61)	VIPR2VIPR1BACE1BACE2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0584244-A1	PEPTIDE INHIBITORS OF INFLAMMATION	THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US)	1994-03-02	—	—	EP	disclosed
WO-1992020708-A1	PEPTIDE INHIBITORS OF INFLAMMATION	BOARD OF REGENTS FOR THE UNIVERSITY OF OKLAHOMA (US)	1992-11-26	—	—	WO	disclosed