SCHEMBL30512658

CSCC[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O

nearest known ligand 0.46

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	CXCL8	P10145	5/20	0.44

▸	CRHR1	P34998	1/20	0.43

▸	CRHR2	Q13324	1/20	0.43

▸	CAPN1	P07384	3/20	0.42

▸	BACE1	P56817	6/20	0.42

▸	CTSD	P07339	3/20	0.42

▸	CALCRL	Q16602	1/20	0.42

▸	CTSE	P14091	1/20	0.41

▸	NTSR1	P30989	1/20	0.41

▸	CALCR	P30988	1/20	0.40

▸	CTSB	P07858	1/20	0.39

▸	BACE2	Q9Y5Z0	1/20	0.39

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
SCHEMBL30512638	0.85	NMUR2 (0.45)	CXCL8CALCR
SCHEMBL30658574	0.85	CALCRL (0.52)	BACE1CTSDCALCRLBACE2
SCHEMBL29511796	0.83	ACE (0.47)	CXCL8BACE1CALCRL
SCHEMBL31318916	0.83	CALCRL (0.51)	BACE1CTSDCALCRLCTSEBACE2
SCHEMBL30658578	0.81	CALCRL (0.49)	BACE1CTSDCALCRLCTSEBACE2
SCHEMBL30608579	0.81	NAA50 (0.48)	CRHR1CRHR2CAPN1CALCRLNTSR1
SCHEMBL30512622	0.80	CALCRL (0.48)	CXCL8BACE1CTSDCALCRLNTSR1
SCHEMBL31743444	0.80	CALCR (0.54)	CRHR1CRHR2BACE1CALCR
SCHEMBL10428029	0.79	KEAP1 (0.47)	CAPN1BACE1CTSDCALCRLBACE2
SCHEMBL30198489	0.79	NAA50 (0.48)	CXCL8CALCR

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