SCHEMBL14567902

C/C(=C\[C@H](C(C)C)N(C)C(=O)[C@@H](NC(=O)[C@@H](N(C)C(=O)OC(C)(C)C)C(C)(C)c1ccccc1)C(C)(C)C)CC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	TUBB1	Q9H4B7	2/20	0.48

▸	STAT6	P42226	2/20	0.33

▸	MMP13	P45452	1/20	0.33

▸	MMP2	P08253	11/20	0.31

▸	CTSS	P25774	1/20	0.31

▸	MMP3	P08254	5/20	0.31

▸	ADAM17	P78536	1/20	0.31

▸	MMP1	P03956	1/20	0.30

▸	MMP9	P14780	1/20	0.30

▸	MMP8	P22894	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
SCHEMBL58237	0.93	TUBB1 (0.48)	TUBB1STAT6MMP13MMP2CTSS
SCHEMBL14210210	0.93	TUBB1 (0.48)	TUBB1STAT6MMP13MMP2CTSS
SCHEMBL14210172	0.89	TUBB1 (0.54)	TUBB1STAT6MMP13CTSS
SCHEMBL14210168	0.89	TUBB1 (0.60)	TUBB1STAT6MMP13CTSS
SCHEMBL57606	0.89	TUBB1 (0.54)	TUBB1STAT6MMP13CTSS
SCHEMBL57529	0.89	TUBB1 (0.60)	TUBB1STAT6MMP13CTSS
SCHEMBL13682586	0.89	TUBB1 (0.60)	TUBB1STAT6MMP13CTSS
SCHEMBL14210208	0.89	TUBB1 (0.49)	TUBB1STAT6MMP13
SCHEMBL12202612	0.89	TUBB1 (0.49)	TUBB1STAT6MMP13
SCHEMBL58571	0.89	TUBB1 (0.49)	TUBB1STAT6MMP13

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-7192972-B2	Hemiasterlin derivatives and uses thereof	EISAI CO., LTD. (JP)	2007-03-20	—	—	US	disclosed
US-7192972-B2	Hemiasterlin derivatives and uses thereof	EISAI CO., LTD. (JP)	2007-03-20	—	—	US	disclosed