SCHEMBL30512588

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	RAMP3	O60896	8/20	0.53

▸	CALCR	P30988	8/20	0.53

▸	NMUR2	Q9GZQ4	3/20	0.52

▸	NMUR1	Q9HB89	3/20	0.52

▸	CXCR4	P61073	4/20	0.51

▸	TFPI	P10646	3/20	0.50

▸	EP300	Q09472	1/20	0.50

▸	HIF1A	Q16665	1/20	0.50

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
SCHEMBL29389599	0.91	RAMP3 (0.54)	RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL30423163	0.91	RAMP3 (0.60)	RAMP3CALCR
SCHEMBL30401141	0.88	NMUR2 (0.53)	RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL31303212	0.88	CXCR4 (0.50)	RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL29453625	0.88	RAMP3 (0.53)	RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL5315506	0.88	RAMP3 (0.59)	RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL5315503	0.88	RAMP3 (0.59)	RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL5313745	0.86	PLK1 (0.47)	RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL5313754	0.86	PLK1 (0.47)	RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL30607285	0.86	CXCR4 (0.58)	CXCR4TFPI

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
CN-116490215-A	Targeted mediated endocytic drug delivery	CRM医疗有限公司	2023-07-25	—	—	CN	disclosed