SCHEMBL17404675

C=C1N[C@H](Cc2c[nH]c3ccccc23)C(=O)NC(CCCCN)C(=O)NC([C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CSSCCC(=O)NC)C(N)=O)CSSC[C@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@H]1Cc1ccc(O)cc1

nearest known ligand 0.69

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	SSTR2	P30874	16/20	0.69

▸	SSTR5	P35346	15/20	0.69

▸	SSTR4	P31391	9/20	0.69

▸	SSTR3	P32745	6/20	0.69

▸	SSTR1	P30872	3/20	0.64

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
SCHEMBL17404680	0.90	SSTR2 (0.69)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL21099762	0.90	SSTR2 (0.78)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL29414545	0.89	SSTR2 (0.84)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL18823537	0.88	SSTR2 (0.70)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL17404648	0.88	SSTR2 (0.72)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL24160859	0.87	SSTR2 (0.83)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL21100168	0.87	SSTR2 (0.72)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL18712687	0.86	SSTR2 (0.81)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL18359775	0.86	SSTR2 (0.65)	SSTR2SSTR5SSTR4SSTR3SSTR1
SCHEMBL21892078	0.86	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-2016004048-A2	TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF	BLEND THERAPEUTICS, INC. (US)	2016-01-07	—	—	WO	disclosed