SCHEMBL31257036

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

nearest known ligand 0.47

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	1/20	0.47

▸	NMT2	O60551	1/20	0.40

▸	NMT1	P30419	1/20	0.40

▸	CCNA2	P20248	2/20	0.39

▸	CDK2	P24941	2/20	0.39

▸	CCNA1	P78396	2/20	0.39

▸	NTSR2	O95665	1/20	0.39

▸	NTSR1	P30989	1/20	0.39

▸	CTSD	P07339	1/20	0.38

▸	RXFP1	Q9HBX9	2/20	0.38

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
SCHEMBL31257011	0.96	BACE1 (0.45)	BACE1NMT2NMT1CCNA2CDK2
SCHEMBL31256970	0.96	BACE1 (0.46)	BACE1
SCHEMBL31257067	0.90	BACE1 (0.47)	BACE1CTSD
SCHEMBL31257006	0.86	ENPEP (0.46)	BACE1CTSD
SCHEMBL30518992	0.86	RXFP1 (0.46)	NMT2NMT1RXFP1
SCHEMBL31757515	0.86	RXFP1 (0.50)	BACE1RXFP1
SCHEMBL2119473	0.85	BACE1 (0.45)	BACE1CCNA2CDK2CCNA1NTSR2
SCHEMBL2119466	0.85	BACE1 (0.45)	BACE1CCNA2CDK2CCNA1NTSR2
SCHEMBL29822483	0.85	CCNA2 (0.40)	BACE1NMT2NMT1CCNA2CDK2
SCHEMBL30767706	0.84	NMT1 (0.46)	BACE1NMT2NMT1CTSD

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
US-20240352445-A1	HUMANIZATION, AFFINITY MATURATION, AND OPTIMIZATION METHODS FOR PROTEINS AND ANTIBODIES	ABWIZ BIO, INC.	2024-10-24	—	—	US	disclosed