SCHEMBL8973444

C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)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](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	RAMP3	O60896	13/20	0.53

▸	CALCR	P30988	13/20	0.53

▸	NPY2R	P49146	6/20	0.50

▸	NPY4R	P50391	6/20	0.50

▸	NPY5R	Q15761	6/20	0.50

▸	NPY1R	P25929	4/20	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
SCHEMBL9118632	0.89	NPY2R (0.45)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30974258	0.86	RAMP3 (0.48)	RAMP3CALCR
SCHEMBL31670625	0.83	RAMP3 (0.53)	RAMP3CALCR
SCHEMBL30542978	0.83	TFPI (0.51)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30033898	0.83	TFPI (0.51)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30974089	0.83	RAMP3 (0.49)	RAMP3CALCR
SCHEMBL30437145	0.83	RAMP3 (0.59)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30516429	0.82	RAMP3 (0.47)	RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30099507	0.82	RAMP3 (0.57)	RAMP3CALCR
SCHEMBL30542981	0.82	TFPI (0.50)	RAMP3CALCRNPY2RNPY4RNPY5R

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-5486595-A	Tumor necrosis factor inhibitors	CENTECOR, INC. (US)	1996-01-23	—	—	US	disclosed