SCHEMBL24864407

CN[C@@H](CCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	FURIN	P09958	13/20	0.39

▸	NPY1R	P25929	1/20	0.36

▸	NPY4R	P50391	1/20	0.36

▸	SIRT2	Q8IXJ6	1/20	0.35

▸	SIRT1	Q96EB6	1/20	0.35

▸	SIRT5	Q9NXA8	1/20	0.34

▸	ROCK2	O75116	1/20	0.34

▸	PRSS1	P07477	1/20	0.34

▸	HTT	P42858	1/20	0.34

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
SCHEMBL22138596	0.92	FURIN (0.39)	FURINNPY1RNPY4RROCK2HTT
SCHEMBL27447192	0.92	FURIN (0.39)	FURINNPY1RNPY4RROCK2HTT
SCHEMBL20705515	0.92	FURIN (0.39)	FURINNPY1RNPY4RROCK2HTT
SCHEMBL27291553	0.90	FURIN (0.38)	FURINNPY1RNPY4RSIRT5
SCHEMBL27291562	0.88	FURIN (0.37)	FURINSIRT2SIRT1SIRT5
SCHEMBL27291550	0.87	FURIN (0.36)	FURINSIRT5
SCHEMBL24864398	0.87	FURIN (0.35)	FURINSIRT2SIRT1SIRT5HTT
SCHEMBL24864452	0.87	FURIN (0.35)	FURINSIRT2SIRT1SIRT5HTT
SCHEMBL27291543	0.86	FURIN (0.35)	FURIN
SCHEMBL15699736	0.86	FURIN (0.40)	FURINNPY1RNPY4RSIRT1SIRT5

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-2023280227-A2	LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME	PROFOUNDBIO US CO. (US)	2023-01-12	—	—	WO	disclosed