SCHEMBL6675014

CCOC(=O)/C(C)=C/[C@H](C(C)C)N(C)C(=O)[C@@H](NC(=O)C(N(C)C(=O)OC(C)(C)C)C(C)(C)c1ccccc1C)C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	TUBB1	Q9H4B7	2/20	0.44

▸	STAT6	P42226	1/20	0.31

▸	GAA	P10253	2/20	0.31

▸	MMP13	P45452	1/20	0.31

▸	DHODH	Q02127	1/20	0.30

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
SCHEMBL6671660	1.00	TUBB1 (0.44)	TUBB1STAT6GAAMMP13DHODH
SCHEMBL6806018	0.92	TUBB1 (0.46)	TUBB1GAA
SCHEMBL22069860	0.90	TUBB1 (0.49)	TUBB1STAT6MMP13
SCHEMBL14210209	0.90	TUBB1 (0.49)	TUBB1STAT6MMP13
SCHEMBL58263	0.90	TUBB1 (0.49)	TUBB1STAT6MMP13
SCHEMBL13660105	0.90	TUBB1 (0.49)	TUBB1STAT6MMP13
SCHEMBL29511164	0.89	TUBB1 (0.49)	TUBB1
SCHEMBL22069915	0.87	TUBB1 (0.40)	TUBB1
SCHEMBL22069916	0.87	TUBB1 (0.40)	TUBB1
SCHEMBL6803333	0.87	TUBB1 (0.59)	TUBB1

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-2004026293-A2	HEMIASTERLIN DERIVATIVES FOR TREATING RESISTANT TUMORS	WYETH HOLDINGS CORPORATION (US)	2004-04-01	—	—	WO	disclosed