SCHEMBL7323558

CCCCCC(=O)N[C@@](Cc1ccccc1-c1ccccc1)(C(=O)NC(C(=O)O)C(C)C)C(CO)CNC(=O)[C@H](C)N(C(=O)OCc1ccccc1)C(=O)[C@H](C)N

nearest known ligand 0.33

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	SIRT2	Q8IXJ6	6/20	0.33

▸	PPARA	Q07869	1/20	0.32

▸	LNPEP	Q9UIQ6	2/20	0.31

▸	ERAP2	Q6P179	1/20	0.31

▸	SIRT1	Q96EB6	3/20	0.31

▸	MEN1	O00255	2/20	0.31

▸	KMT2A	Q03164	2/20	0.31

▸	ALDH1A1	P00352	1/20	0.31

▸	HPGD	P15428	1/20	0.31

▸	SIRT3	Q9NTG7	2/20	0.30

▸	CAPN1	P07384	1/20	0.30

▸	CAPN2	P17655	1/20	0.30

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
SCHEMBL7333687	0.96	SIRT2 (0.32)	SIRT2LNPEPERAP2SIRT1MEN1
SCHEMBL7332120	0.93	SIRT2 (0.33)	SIRT2PPARASIRT1MEN1KMT2A
SCHEMBL7328766	0.89	SOAT1 (0.31)	PPARA
SCHEMBL7331504	0.86	SIRT2 (0.38)	SIRT2SIRT1MEN1KMT2ASIRT3
SCHEMBL7323101	0.85	SIRT2 (0.33)	SIRT2PPARASIRT1MEN1KMT2A
SCHEMBL7330316	0.84	SOAT1 (0.31)	—
SCHEMBL9297056	0.84	SIRT2 (0.34)	SIRT2PPARASIRT1MEN1KMT2A
SCHEMBL7324588	0.81	CTSD (0.32)	—
SCHEMBL7331182	0.81	SOAT1 (0.32)	—
SCHEMBL7326622	0.81	CTSB (0.41)	SIRT2SIRT1MEN1KMT2ASIRT3

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
WO-1990000399-A1	RETROVIRAL PROTEASE BINDING PEPTIDES	SMITHKLINE BECKMAN CORPORATION (US)	1990-01-25	—	—	WO	disclosed
EP-0352000-A2	Retroviral protease binding peptides	SMITHKLINE BEECHAM CORPORATION (US)	1990-01-24	—	—	EP	disclosed