SCHEMBL12944751

CC[C@H](N)C(=O)N1C[C@@H](OC(C)=O)C[C@H]1Cc1c(-c2[nH]c3cc(F)ccc3c2C[C@@H]2CC(OC(C)=O)CN2C(C)=O)[nH]c2cc(F)ccc12

nearest known ligand 0.54

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	BIRC3	Q13489	16/20	0.54

▸	XIAP	P98170	14/20	0.54

▸	BIRC2	Q13490	2/20	0.54

▸	BIRC7	Q96CA5	1/20	0.54

▸	TNF	P01375	9/20	0.42

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
SCHEMBL949964	0.97	BIRC3 (0.55)	BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL17277661	0.97	BIRC3 (0.55)	BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL12944780	0.97	BIRC3 (0.55)	BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL12914213	0.97	BIRC3 (0.55)	BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL5019948	0.97	BIRC3 (0.55)	BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL19054948	0.94	BIRC3 (0.52)	BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL12914214	0.89	BIRC3 (0.48)	BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL5019965	0.89	BIRC3 (0.46)	BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL25461010	0.83	BIRC3 (0.60)	BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL5037496	0.83	BIRC3 (0.80)	BIRC3XIAPBIRC2BIRC7TNF

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-2011002684-A1	SMAC MIMETIC	TETRALOGIC PHARMACEUTICALS CORP. (US)	2011-01-06	—	—	WO	disclosed