SCHEMBL9118632

C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)O)C(=O)N[C@H]([C]=O)CCCNC(=N)N

nearest known ligand 0.45

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	7/20	0.45

▸	NPY4R	P50391	7/20	0.45

▸	NPY5R	Q15761	7/20	0.45

▸	NPY1R	P25929	5/20	0.45

▸	RAMP3	O60896	12/20	0.44

▸	CALCR	P30988	12/20	0.44

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
SCHEMBL8973444	0.89	RAMP3 (0.53)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL3214306	0.83	NPY2R (0.49)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30099507	0.80	RAMP3 (0.57)	RAMP3CALCR
SCHEMBL30974258	0.80	RAMP3 (0.48)	RAMP3CALCR
SCHEMBL30900803	0.79	NPY2R (0.52)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30033652	0.79	KEAP1 (0.50)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30032812	0.77	RAMP3 (0.50)	RAMP3CALCR
SCHEMBL29995107	0.77	RAMP3 (0.47)	RAMP3CALCR
SCHEMBL30900795	0.77	NPY2R (0.57)	NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30957282	0.76	EPHA2 (0.49)	RAMP3CALCR

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
WO-1995026744-A1	TUMOR NECROSIS FACTOR INHIBITORS	CENTOCOR, INC. (US)	1995-10-12	—	—	WO	disclosed