SCHEMBL3209141

C[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H]([C]=O)CCCNC(=N)N)[C@@H](C)O

nearest known ligand 0.42

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	FURIN	P09958	1/20	0.38

▸	IL23R	Q5VWK5	4/20	0.38

▸	HASPIN	Q8TF76	1/20	0.37

▸	VIPR2	P41587	3/20	0.37

▸	VIPR1	P32241	1/20	0.37

▸	NPY4R	P50391	1/20	0.36

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
SCHEMBL3215006	0.89	MAPK8 (0.38)	IL23RHASPINVIPR2VIPR1
SCHEMBL3203608	0.89	BACE1 (0.39)	FURINIL23R
SCHEMBL3212582	0.86	MAPK8 (0.41)	VIPR2VIPR1NPY4R
SCHEMBL6117674	0.84	FURIN (0.40)	FURIN
SCHEMBL2467105	0.84	FURIN (0.40)	FURIN
SCHEMBL15263460	0.84	NPY4R (0.48)	FURINNPY4R
SCHEMBL30681588	0.84	VIPR2 (0.49)	IL23RVIPR2VIPR1
SCHEMBL676551	0.83	BACE1 (0.45)	FURIN
SCHEMBL30361652	0.83	BACE1 (0.45)	FURIN
SCHEMBL30811131	0.82	NPY4R (0.45)	NPY4R

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-20100047762-A1	METHOD TO MONITOR DRUG EFFICACY IN DIABETIC PATIENTS USING AN ASSAY FOR 1,5-ANHYDRO-D-GLUCITOL	NIPPON KAYAKU KABUSHIKI KAISHA (JP)	2010-02-25	—	—	US	disclosed