SCHEMBL19976520

CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCS(=O)(=O)O)OC)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)SS)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	CYP3A4	P08684	1/20	0.42

▸	SSTR2	P30874	2/20	0.41

▸	FOLH1	Q04609	3/20	0.37

▸	TTR	P02766	2/20	0.36

▸	CTSD	P07339	6/20	0.33

▸	CTSE	P14091	6/20	0.33

▸	BACE1	P56817	4/20	0.33

▸	REN	P00797	1/20	0.33

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
SCHEMBL22559870	0.95	CYP3A4 (0.43)	CYP3A4SSTR2FOLH1TTRCTSD
SCHEMBL19372571	0.94	CYP3A4 (0.42)	CYP3A4SSTR2FOLH1TTRCTSD
SCHEMBL20684299	0.94	CYP3A4 (0.43)	CYP3A4SSTR2FOLH1TTRCTSD
SCHEMBL1687443	0.94	CYP3A4 (0.43)	CYP3A4SSTR2FOLH1TTRCTSD
SCHEMBL15047596	0.94	CYP3A4 (0.43)	CYP3A4SSTR2FOLH1TTRCTSD
SCHEMBL19490727	0.94	CYP3A4 (0.42)	CYP3A4SSTR2FOLH1TTRCTSD
SCHEMBL2734904	0.94	CYP3A4 (0.42)	CYP3A4SSTR2FOLH1TTRCTSD
SCHEMBL18948699	0.93	CYP3A4 (0.43)	CYP3A4SSTR2FOLH1TTRCTSD
SCHEMBL13034951	0.93	CYP3A4 (0.42)	CYP3A4SSTR2FOLH1TTRCTSD
SCHEMBL13838248	0.91	CYP3A4 (0.41)	CYP3A4SSTR2FOLH1TTRCTSD

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
US-9919061-B2	CD19 binding agents and uses thereof	SEATTLE GENETICS, INC. (US)	2018-03-20	—	—	US	disclosed