SCHEMBL29723217

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	XIAP	P98170	1/20	0.51

▸	PTPN1	P18031	1/20	0.44

▸	NTSR1	P30989	10/20	0.41

▸	NTSR2	O95665	8/20	0.41

▸	SORT1	Q99523	7/20	0.41

▸	GRB2	P62993	1/20	0.41

▸	ACE	P12821	2/20	0.39

▸	REN	P00797	2/20	0.39

▸	F2	P00734	1/20	0.39

▸	LNPEP	Q9UIQ6	2/20	0.39

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
SCHEMBL29723433	0.84	F2 (0.50)	NTSR1NTSR2SORT1F2
SCHEMBL29723164	0.84	PTPN1 (0.42)	XIAPPTPN1REN
SCHEMBL28290901	0.83	XIAP (0.59)	XIAPPTPN1NTSR1NTSR2SORT1
SCHEMBL29641846	0.80	GRB2 (0.51)	XIAPGRB2ACEREN
SCHEMBL31256986	0.79	XIAP (0.58)	XIAPGRB2LNPEP
SCHEMBL30946064	0.79	SLC6A2 (0.56)	NTSR1NTSR2SORT1LNPEP
SCHEMBL31461965	0.79	EP300 (0.46)	NTSR1F2
SCHEMBL6524113	0.78	NTSR1 (0.47)	XIAPNTSR1NTSR2SORT1F2
SCHEMBL31235872	0.77	XIAP (0.46)	XIAPF2
SCHEMBL30052704	0.77	XIAP (0.77)	XIAP

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
EP-3538543-B1	PROTRANSDUZIN-S - AN ENHANCER OF GENE TRANSFER	PHARIS BIOTEC GMBH (DE)	2022-06-08	—	—	EP	claimed
EP-3538543-B1	PROTRANSDUZIN-S - AN ENHANCER OF GENE TRANSFER	PHARIS BIOTEC GMBH (DE)	2022-06-08	—	—	EP	disclosed