SCHEMBL16349776

CCCC[C@H](NC(=O)[C@H](CSC(C)(C)C)NC(=O)[C@H](CCCCN)NC(=O)CCl)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CSC(C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)NCCOCCOCCOCCNC(=O)COCC(=O)NCCOCCOCCOCCNC(=O)COCC(N)=O

nearest known ligand 0.52

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	11/20	0.52

▸	CCKAR	P32238	9/20	0.50

▸	CCKBR	P32239	9/20	0.50

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
SCHEMBL16349755	1.00	IL23R (0.52)	IL23RCCKARCCKBR
SCHEMBL13870355	0.94	IL23R (0.56)	IL23R
SCHEMBL20810079	0.94	IL23R (0.56)	IL23R
SCHEMBL23057496	0.94	IL23R (0.56)	IL23R
SCHEMBL13870345	0.94	IL23R (0.56)	IL23R
SCHEMBL10052936	0.91	IL23R (0.53)	IL23R
SCHEMBL12353632	0.91	IL23R (0.54)	IL23R
SCHEMBL22004635	0.90	IL23R (0.52)	IL23RCCKARCCKBR
SCHEMBL13870329	0.90	IL23R (0.54)	IL23R
SCHEMBL13659872	0.87	IL23R (0.52)	IL23R

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-7521419-B2	Peptide-based compounds	GE HEALTHCARE AS (NO)	2009-04-21	—	—	US	disclosed