SCHEMBL16358283

CC[C@H](C)[C@H](NC(=O)[C@@H](CCNC(=O)OCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)C(N)[C@H](O)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@H](C)O

nearest known ligand 0.49

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	CTSB	P07858	4/20	0.48

▸	CTSK	P43235	4/20	0.48

▸	OPRM1	P35372	4/20	0.47

▸	OPRD1	P41143	4/20	0.47

▸	OPRK1	P41145	1/20	0.47

▸	CTSD	P07339	5/20	0.43

▸	REN	P00797	1/20	0.43

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
SCHEMBL13723426	0.96	OPRM1 (0.49)	CTSBCTSKOPRM1OPRD1OPRK1
SCHEMBL14404862	0.96	OPRM1 (0.49)	CTSBCTSKOPRM1OPRD1OPRK1
SCHEMBL16358284	0.96	OPRM1 (0.49)	CTSBCTSKOPRM1OPRD1OPRK1
SCHEMBL13724356	0.96	OPRM1 (0.49)	CTSBCTSKOPRM1OPRD1OPRK1
SCHEMBL13723350	0.93	OPRM1 (0.46)	CTSBCTSKOPRM1OPRD1OPRK1
SCHEMBL13723021	0.92	KISS1R (0.50)	CTSBCTSKOPRM1OPRD1OPRK1
SCHEMBL13723358	0.92	OPRM1 (0.47)	CTSBCTSKOPRM1OPRD1OPRK1
SCHEMBL16318406	0.92	OPRM1 (0.47)	CTSBCTSKOPRM1OPRD1OPRK1
SCHEMBL2367459	0.90	CTSB (0.45)	CTSBCTSKOPRM1OPRD1CTSD
SCHEMBL2367948	0.86	CTSB (0.44)	CTSBCTSKOPRM1OPRD1OPRK1

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-2007118691-A1	LYSOBACTIN AMIDES	AICURIS GMBH & CO. KG (DE)	2007-10-25	—	—	WO	disclosed