SCHEMBL2367832

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

nearest known ligand 0.37

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	RXFP1	Q9HBX9	1/20	0.37

▸	KEAP1	Q14145	2/20	0.35

▸	NPY4R	P50391	1/20	0.35

▸	RXFP4	Q8TDU9	1/20	0.34

▸	RXFP3	Q9NSD7	1/20	0.34

▸	OPRL1	P41146	1/20	0.33

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
SCHEMBL2367412	0.99	RXFP1 (0.39)	RXFP1KEAP1NPY4RRXFP4RXFP3
SCHEMBL2371869	0.97	RXFP1 (0.36)	RXFP1KEAP1NPY4RRXFP4RXFP3
SCHEMBL2367091	0.97	RXFP1 (0.41)	RXFP1KEAP1NPY4R
SCHEMBL2367458	0.95	RXFP1 (0.35)	RXFP1KEAP1NPY4RRXFP4RXFP3
SCHEMBL2368042	0.93	RXFP1 (0.44)	RXFP1KEAP1NPY4R
SCHEMBL2366814	0.93	RXFP1 (0.42)	RXFP1KEAP1NPY4R
SCHEMBL2367128	0.92	NPY4R (0.41)	RXFP1KEAP1NPY4R
SCHEMBL3046711	0.92	RXFP1 (0.40)	RXFP1KEAP1NPY4RRXFP4RXFP3
SCHEMBL2367191	0.92	NPY4R (0.43)	KEAP1NPY4R
SCHEMBL2367032	0.91	RXFP1 (0.40)	RXFP1KEAP1NPY4R

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