SCHEMBL24864648

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

nearest known ligand 0.33

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	FURIN	P09958	8/20	0.33

▸	ROCK2	O75116	1/20	0.31

▸	RXFP1	Q9HBX9	1/20	0.31

▸	NMT2	O60551	1/20	0.31

▸	NMT1	P30419	1/20	0.31

▸	FAP	Q12884	1/20	0.30

▸	IL23R	Q5VWK5	1/20	0.30

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
SCHEMBL24864477	0.97	FURIN (0.34)	FURINROCK2RXFP1NMT2NMT1
SCHEMBL24864452	0.95	FURIN (0.35)	FURINFAPIL23R
SCHEMBL24864398	0.95	FURIN (0.35)	FURINFAPIL23R
SCHEMBL24864485	0.94	FAP (0.32)	FURINFAP
SCHEMBL24864391	0.92	FURIN (0.33)	FURINROCK2RXFP1NMT2NMT1
SCHEMBL24864380	0.91	FAP (0.40)	FURINROCK2RXFP1NMT2NMT1
SCHEMBL24864406	0.90	FURIN (0.35)	FURINIL23R
SCHEMBL24864376	0.90	FURIN (0.34)	FURINFAP
SCHEMBL24864529	0.89	FURIN (0.34)	FURINIL23R
SCHEMBL24864375	0.89	FURIN (0.34)	FURINFAP

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