SCHEMBL7074831

CC[C@H](C)[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 4)

	gene	UniProt	supporting neighbours	confidence
▸	FNTA	P49354	12/20	0.58

▸	FNTB	P49356	12/20	0.58

▸	PGGT1B	P53609	7/20	0.57

▸	BACE1	P56817	1/20	0.52

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
SCHEMBL7074828	1.00	FNTA (0.58)	FNTAFNTBPGGT1BBACE1
SCHEMBL6809801	0.97	BACE1 (0.56)	FNTAFNTBPGGT1BBACE1
SCHEMBL6809794	0.97	BACE1 (0.56)	FNTAFNTBPGGT1BBACE1
SCHEMBL6810443	0.90	FNTA (0.63)	FNTAFNTBPGGT1BBACE1
SCHEMBL6810437	0.90	FNTA (0.63)	FNTAFNTBPGGT1BBACE1
SCHEMBL6814564	0.88	FNTA (0.58)	FNTAFNTBPGGT1B
SCHEMBL6814551	0.88	FNTA (0.58)	FNTAFNTBPGGT1B
SCHEMBL7069273	0.87	FNTA (0.64)	FNTAFNTBPGGT1BBACE1
SCHEMBL31556395	0.85	ACE (0.53)	FNTAFNTBBACE1
SCHEMBL8519036	0.85	FNTA (0.78)	FNTAFNTBPGGT1B

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-2003055448-A2	ANTIFUNGAL COMPOSITIONS	ACHILLION PHARMACEUTICALS, INC. (US)	2003-07-10	—	—	WO	disclosed