SCHEMBL30974002

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)C(C)C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	9/20	0.51

▸	FOLH1	Q04609	7/20	0.50

▸	EGFR	P00533	1/20	0.41

▸	PTPN1	P18031	1/20	0.40

▸	CTSD	P07339	1/20	0.40

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
SCHEMBL30973961	0.92	FOLH1 (0.56)	BACE1FOLH1CTSD
SCHEMBL38659671	0.91	FOLH1 (0.52)	BACE1FOLH1EGFRPTPN1
SCHEMBL31257001	0.90	CPB2 (0.45)	BACE1FOLH1
SCHEMBL30284335	0.90	CPB2 (0.45)	FOLH1
SCHEMBL29777821	0.90	BACE1 (0.51)	BACE1CTSD
SCHEMBL29714787	0.89	FOLH1 (0.63)	BACE1FOLH1
SCHEMBL38658308	0.88	PTPN1 (0.51)	BACE1FOLH1EGFRPTPN1CTSD
SCHEMBL38659780	0.88	PTPN1 (0.51)	BACE1FOLH1EGFRPTPN1CTSD
SCHEMBL29876561	0.87	FOLH1 (0.53)	BACE1FOLH1EGFRCTSD
SCHEMBL29934072	0.87	FOLH1 (0.53)	BACE1FOLH1EGFRCTSD

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-2024132726-A1	SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE	UNIWERSYTET GDANSKI (PL)	2024-06-27	—	—	WO	claimed