SCHEMBL18359788

C[C@@H](O)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)NC2CCCCC2)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1)C(=O)NCCCCCN1C(=O)C=CC1=O

nearest known ligand 0.72

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	SSTR2	P30874	15/20	0.72

▸	SSTR5	P35346	12/20	0.60

▸	SSTR4	P31391	10/20	0.60

▸	SSTR3	P32745	6/20	0.57

▸	SSTR1	P30872	3/20	0.52

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
SCHEMBL20963308	1.00	SSTR2 (0.72)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL18360001	0.94	SSTR2 (0.74)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL20963129	0.94	SSTR2 (0.74)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL17404647	0.93	SSTR2 (0.78)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL18712912	0.93	SSTR2 (0.78)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL18359969	0.93	SSTR2 (0.81)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL18359851	0.90	SSTR2 (0.71)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL20963169	0.90	SSTR2 (0.68)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL20963312	0.90	SSTR2 (0.68)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL18360002	0.89	SSTR2 (0.68)	SSTR2SSTR5SSTR4SSTR3SSTR1

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-2017003940-A1	TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF	TARVEDA THERAPEUTICS, INC. (US)	2017-01-05	—	—	WO	disclosed