SCHEMBL24872354

N=C(N)NCCC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@H](N)CCCCCn2nnc3c2CC[C@@H]2[C@H](CC3)[C@@H]2COC(=O)NCCCCCC(=O)N2C[C@H](O)C[C@H]2CO[PH](=O)O)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)CNC1=O

nearest known ligand 0.44

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	MC4R	P32245	15/20	0.44

▸	MC5R	P33032	15/20	0.44

▸	MC3R	P41968	15/20	0.44

▸	MC1R	Q01726	14/20	0.43

▸	ITGB3	P05106	4/20	0.36

▸	ITGAV	P06756	4/20	0.36

▸	ITGB1	P05556	3/20	0.36

▸	ITGA5	P08648	3/20	0.36

▸	ITGB5	P18084	1/20	0.36

▸	TSLP	Q969D9	1/20	0.35

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
SCHEMBL24872452	0.84	ITGB3 (0.47)	MC4RMC5RMC3RMC1RITGB3
SCHEMBL24872356	0.83	MC4R (0.42)	MC4RMC5RMC3RMC1RITGB3
SCHEMBL22970321	0.71	ITGB3 (0.56)	MC4RMC5RMC3RMC1RITGB3
SCHEMBL19981446	0.71	ITGB3 (0.56)	MC4RMC5RMC3RMC1RITGB3
SCHEMBL7744260	0.71	ITGB3 (0.56)	MC4RMC5RMC3RMC1RITGB3
SCHEMBL7743670	0.71	ITGB3 (0.56)	MC4RMC5RMC3RMC1RITGB3
SCHEMBL22872747	0.70	ITGB3 (0.51)	MC4RMC5RMC3RMC1RITGB3
SCHEMBL24872339	0.70	ITGB3 (0.49)	MC4RMC5RMC3RMC1RITGB3
SCHEMBL22789359	0.70	ITGB3 (0.51)	MC4RMC5RMC3RMC1RITGB3
SCHEMBL22807688	0.69	ITGB3 (0.53)	MC4RMC5RMC3RMC1RITGB3

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-2023283595-A2	INTEGRIN TARGETING LIGANDS FOR OCULAR DELIVERY OF RNAI COMPOUNDS	ALNYLAM PHARMACEUTICALS, INC. (US)	2023-01-12	—	—	WO	disclosed