SCHEMBL30578429

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	F2	P00734	2/20	0.48

▸	TLR2	O60603	2/20	0.47

▸	PTPN1	P18031	8/20	0.45

▸	CTSD	P07339	1/20	0.42

▸	REN	P00797	1/20	0.41

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
SCHEMBL30578464	1.00	F2 (0.48)	F2TLR2PTPN1CTSDREN
SCHEMBL30578467	1.00	F2 (0.48)	F2TLR2PTPN1CTSDREN
SCHEMBL30578470	0.93	TLR2 (0.50)	F2TLR2
SCHEMBL30578434	0.93	TLR2 (0.50)	F2TLR2
SCHEMBL30578436	0.93	TLR2 (0.50)	F2TLR2
SCHEMBL30578445	0.92	TLR2 (0.48)	TLR2PTPN1CTSD
SCHEMBL30578433	0.92	TLR2 (0.48)	TLR2PTPN1CTSD
SCHEMBL31174195	0.88	PCSK9 (0.50)	—
SCHEMBL30578460	0.88	PCSK9 (0.50)	—
SCHEMBL30578477	0.88	PCSK9 (0.50)	—

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-116970035-A	G-based (XXKK) n Antibacterial peptide synthesized by I template and application thereof	兰州大学	2023-10-31	—	—	CN	disclosed