SCHEMBL9074217

CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.62

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	CCKBR	P32239	11/20	0.60

▸	KISS1R	Q969F8	3/20	0.57

▸	CCKAR	P32238	1/20	0.52

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
SCHEMBL9074213	1.00	CCKBR (0.60)	CCKBRKISS1RCCKAR
SCHEMBL30999648	0.90	CCKBR (0.62)	CCKBRCCKAR
SCHEMBL30045690	0.87	CCKBR (0.60)	CCKBRCCKAR
SCHEMBL30999593	0.87	CCKBR (0.54)	CCKBRCCKAR
SCHEMBL30999611	0.85	CCKBR (0.74)	CCKBRCCKAR
SCHEMBL30999544	0.85	CCKBR (0.74)	CCKBRCCKAR
SCHEMBL30999587	0.85	CCKBR (0.74)	CCKBRCCKAR
SCHEMBL30999592	0.85	CCKBR (0.74)	CCKBRCCKAR
SCHEMBL30999586	0.85	CCKBR (0.74)	CCKBRCCKAR
SCHEMBL30045143	0.84	EDNRA (0.57)	CCKBRCCKAR

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
US-5519000-A	OLIGOPEPTIDE	CENTECOR, INC. (US)	1996-05-21	—	—	US	disclosed
WO-1995026744-A1	TUMOR NECROSIS FACTOR INHIBITORS	CENTOCOR, INC. (US)	1995-10-12	—	—	WO	disclosed