SCHEMBL16349574

CC(C)(C)OC(=O)NCCCN(CCCCN(CC(CCCCCCOS(C)(=O)=O)CN(CCCCN(CCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	CA14	Q9ULX7	2/20	0.46

▸	TDP1	Q9NUW8	1/20	0.41

▸	MEN1	O00255	2/20	0.39

▸	KMT2A	Q03164	2/20	0.39

▸	GAA	P10253	1/20	0.39

▸	CA1	P00915	14/20	0.38

▸	CA2	P00918	14/20	0.38

▸	CA12	O43570	8/20	0.38

▸	CA9	Q16790	7/20	0.38

▸	MAOA	P21397	1/20	0.35

▸	MAOB	P27338	1/20	0.35

▸	POLB	P06746	1/20	0.31

▸	NPSR1	Q6W5P4	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
SCHEMBL16349550	0.86	TDP1 (0.57)	CA14TDP1MEN1KMT2AGAA
SCHEMBL26670001	0.86	CA14 (0.53)	CA14TDP1MEN1KMT2AGAA
SCHEMBL13327112	0.85	CA14 (0.36)	CA14
SCHEMBL16349495	0.84	CA14 (0.50)	CA14TDP1MEN1KMT2AGAA
SCHEMBL16349523	0.84	CA14 (0.50)	CA14TDP1MEN1KMT2AGAA
SCHEMBL13327079	0.84	TDP1 (0.60)	CA14TDP1MEN1KMT2AGAA
SCHEMBL3287433	0.84	CA14 (0.38)	CA14TDP1MEN1KMT2AGAA
SCHEMBL16349526	0.82	CA14 (0.48)	CA14TDP1MEN1KMT2AGAA
SCHEMBL13865394	0.82	CA14 (0.48)	CA14TDP1MEN1KMT2AGAA
SCHEMBL13327086	0.82	TDP1 (0.47)	CA14TDP1MEN1KMT2AGAA

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-7718157-B1	Targeted lipid particles	BAKER TERENCE SEWARD	2010-05-18	—	—	US	disclosed
US-7531676-B2	Lipids	CELLTECH R & D LIMITED (GB)	2009-05-12	—	—	US	disclosed