SCHEMBL30980370

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

nearest known ligand 0.51

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	18/20	0.51

▸	BACE2	Q9Y5Z0	5/20	0.51

▸	CTSD	P07339	2/20	0.48

▸	TEAD4	Q15561	1/20	0.44

▸	TEAD3	Q99594	1/20	0.44

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
SCHEMBL30512032	0.91	BACE1 (0.49)	BACE1BACE2CTSDTEAD4TEAD3
SCHEMBL29609184	0.88	BACE1 (0.56)	BACE1BACE2CTSD
SCHEMBL31666002	0.86	BACE1 (0.45)	BACE1CTSD
SCHEMBL30272510	0.86	FNTA (0.52)	BACE1BACE2CTSD
SCHEMBL29897680	0.86	BACE1 (0.56)	BACE1BACE2CTSD
SCHEMBL30930193	0.85	MME (0.47)	BACE1BACE2CTSD
SCHEMBL29350002	0.85	MME (0.54)	BACE1BACE2CTSD
SCHEMBL30262109	0.85	BACE1 (0.49)	BACE1BACE2CTSD
SCHEMBL31666003	0.84	BACE1 (0.45)	BACE1BACE2CTSD
SCHEMBL31341151	0.84	BACE1 (0.56)	BACE1BACE2CTSD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-20240366738-A1	MOLECULAR VACCINES FOR INFECTIOUS DISEASE	AGILENT TECHNOLOGIES INC (US)	2024-11-07	—	—	US	disclosed
US-11992518-B2	Molecular vaccines for infectious disease	AGILENT TECHNOLOGIES, INC. (US)	2024-05-28	—	—	US	disclosed