SCHEMBL19866067

CN[C@@H](CC(C)C)C(=O)NC(=O)[C@@H](C)NC(=O)N(C)[C@@H](C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@H](C(=O)N(C)[C@@H](C(N)=O)C(C)N1CCOCC1)C(C)C)C(C)C

nearest known ligand 0.31

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	MMP1	P03956	1/20	0.31

▸	ADAM17	P78536	1/20	0.31

▸	CTSS	P25774	1/20	0.31

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
SCHEMBL19866065	0.81	MMP2 (0.31)	—
SCHEMBL19866070	0.81	CTSS (0.36)	CTSS
SCHEMBL19866117	0.80	MMP2 (0.33)	MMP1
SCHEMBL19866115	0.73	—	—
SCHEMBL19866035	0.71	MMP2 (0.31)	—
SCHEMBL27838626	0.69	BACE1 (0.36)	—
SCHEMBL19866116	0.66	—	—
SCHEMBL19955022	0.66	MMP2 (0.33)	—
SCHEMBL19955025	0.66	MMP2 (0.33)	—
SCHEMBL16359824	0.64	ALDH1A1 (0.33)	—

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
EP-2855508-B1	CYCLOSPORIN A ANALOGS	ALLERGAN INC (US)	2018-02-14	—	—	EP	disclosed