SCHEMBL2367128

CC[C@H](C)[C@H](NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](COC(=O)C(F)(F)F)C(=O)N[C@@H](COC(=O)C(F)(F)F)C(=O)O)[C@H](C)O

nearest known ligand 0.41

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	NPY4R	P50391	5/20	0.41

▸	RXFP1	Q9HBX9	1/20	0.41

▸	KEAP1	Q14145	2/20	0.40

▸	F2RL1	P55085	1/20	0.38

▸	NPY1R	P25929	3/20	0.37

▸	NPY2R	P49146	2/20	0.37

▸	NPY5R	Q15761	2/20	0.37

▸	VIPR1	P32241	1/20	0.37

▸	VIPR2	P41587	1/20	0.37

▸	RAMP3	O60896	4/20	0.37

▸	CALCR	P30988	4/20	0.37

▸	KRAS	P01116	1/20	0.37

▸	PTH1R	Q03431	1/20	0.37

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
SCHEMBL2367091	0.95	RXFP1 (0.41)	NPY4RRXFP1KEAP1F2RL1NPY1R
SCHEMBL2368042	0.92	RXFP1 (0.44)	NPY4RRXFP1KEAP1F2RL1NPY1R
SCHEMBL2366814	0.92	RXFP1 (0.42)	NPY4RRXFP1KEAP1F2RL1NPY1R
SCHEMBL2367832	0.92	RXFP1 (0.37)	NPY4RRXFP1KEAP1
SCHEMBL2367412	0.91	RXFP1 (0.39)	NPY4RRXFP1KEAP1VIPR2PTH1R
SCHEMBL3046711	0.91	RXFP1 (0.40)	NPY4RRXFP1KEAP1NPY1RNPY2R
SCHEMBL2367191	0.90	NPY4R (0.43)	NPY4RKEAP1NPY1RNPY2RNPY5R
SCHEMBL2367400	0.90	RXFP1 (0.40)	NPY4RRXFP1KEAP1VIPR1VIPR2
SCHEMBL2367032	0.90	RXFP1 (0.40)	NPY4RRXFP1KEAP1VIPR1VIPR2
SCHEMBL2367313	0.90	NPY4R (0.42)	NPY4RRXFP1KEAP1NPY1RNPY2R

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
EP-2007794-B1	LYSOBACTIN AMIDES	AICURIS GMBH & CO KG (DE)	2011-09-14	—	—	EP	disclosed