SCHEMBL17404645

CC[C@H](Cc1ccccc1)C(=O)N[C@H]1CSSC[C@@H](C(=O)N[C@H](CO)C(C)O)NC(=O)C([C@@H](C)O)NC(=O)C(CCCCNC(=O)OC(C)(C)C)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC1=O

nearest known ligand 0.72

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	SSTR2	P30874	14/20	0.72

▸	SSTR5	P35346	9/20	0.72

▸	SSTR4	P31391	7/20	0.72

▸	SSTR3	P32745	2/20	0.65

▸	SSTR1	P30872	1/20	0.56

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
SCHEMBL17404744	0.94	SSTR2 (0.83)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL17404625	0.94	SSTR2 (0.83)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL25500426	0.94	SSTR2 (0.83)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL21892076	0.93	SSTR2 (0.82)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL18712544	0.93	SSTR2 (0.82)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL13814079	0.92	SSTR2 (0.74)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL18712898	0.90	SSTR2 (0.76)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL17404646	0.90	SSTR2 (0.72)	SSTR2SSTR5SSTR4SSTR3
SCHEMBL25787635	0.90	SSTR2 (0.70)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL17404678	0.89	SSTR2 (0.78)	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-2016004048-A2	TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF	BLEND THERAPEUTICS, INC. (US)	2016-01-07	—	—	WO	disclosed