SCHEMBL8662040

CON1C(=O)CCC(=O)[C@]1(C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	ELANE	P08246	13/20	0.40

▸	XIAP	P98170	2/20	0.38

▸	MLX	Q9UH92	1/20	0.37

▸	CMA1	P23946	3/20	0.36

▸	BIRC2	Q13490	1/20	0.34

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
SCHEMBL2289363	0.97	ELANE (0.42)	ELANEXIAPMLXCMA1
SCHEMBL228960	0.87	ELANE (0.38)	ELANEXIAPMLXCMA1
SCHEMBL5487413	0.87	ELANE (0.38)	ELANEXIAPMLXCMA1BIRC2
SCHEMBL3276266	0.85	ELANE (0.42)	ELANEXIAPMLXCMA1
SCHEMBL535732	0.85	ACE (0.40)	—
SCHEMBL230923	0.82	ELANE (0.33)	ELANECMA1
SCHEMBL5494650	0.82	ELANE (0.40)	ELANEXIAPMLXCMA1
SCHEMBL387694	0.82	TACR1 (0.40)	ELANEXIAPMLXCMA1
SCHEMBL847832	0.81	CMA1 (0.49)	XIAPCMA1
SCHEMBL398010	0.81	KCNH2 (0.39)	—

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-5776780-A	AUTOMATIC ANALYZING; COLORIMETRIC PHOTOMETRY	CHIMERA RESEARCH & CHEMICAL, INC. (US)	1998-07-07	—	—	US	disclosed