SCHEMBL30033370

CC(C)[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	FURIN	P09958	2/20	0.42

▸	FOLH1	Q04609	1/20	0.41

▸	BACE1	P56817	5/20	0.40

▸	CTSD	P07339	1/20	0.40

▸	NMT2	O60551	1/20	0.40

▸	NMT1	P30419	1/20	0.40

▸	OPRL1	P41146	1/20	0.39

▸	BACE2	Q9Y5Z0	1/20	0.39

▸	KEAP1	Q14145	1/20	0.38

▸	PRSS1	P07477	1/20	0.38

▸	OPRM1	P35372	1/20	0.38

▸	OPRD1	P41143	1/20	0.38

▸	OPRK1	P41145	1/20	0.38

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
SCHEMBL30034846	0.94	FURIN (0.43)	FURINNMT2NMT1OPRL1PRSS1
SCHEMBL30032541	0.92	BACE1 (0.45)	FURINFOLH1BACE1CTSDOPRL1
SCHEMBL31031517	0.91	BACE1 (0.44)	BACE1CTSDBACE2KEAP1
SCHEMBL30767706	0.91	NMT1 (0.46)	FURINBACE1CTSDNMT2NMT1
SCHEMBL30033635	0.90	EGFR (0.46)	FURINFOLH1BACE1CTSDNMT2
SCHEMBL30033871	0.89	BACE1 (0.46)	FURINFOLH1BACE1CTSDBACE2
SCHEMBL29575493	0.89	TFPI (0.46)	OPRL1KEAP1
SCHEMBL30712887	0.89	BACE1 (0.49)	BACE1CTSDBACE2OPRM1OPRD1
SCHEMBL31031475	0.88	FOLH1 (0.47)	FURINFOLH1BACE1CTSDBACE2
SCHEMBL11249367	0.88	FOLH1 (0.52)	FOLH1BACE1CTSDNMT2NMT1

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-2981292-B1	SUPRAMOLECULAR AGGREGATES COMPRISING A MALEIMIDO CORE	UFPEPTIDES S R L (IT)	2022-11-02	—	—	EP	disclosed