SCHEMBL7265960

CC(C)(C)OC(=O)NCCCCC(CCCNC(=O)OC(C)(C)C)(NC(=O)OC(C)(C)C)C(CCCCCCOS(C)(=O)=O)CN(CCCC(CCCNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	MEN1	O00255	2/20	0.33

▸	KMT2A	Q03164	2/20	0.33

▸	GAA	P10253	1/20	0.33

▸	CA1	P00915	6/20	0.33

▸	CA2	P00918	6/20	0.33

▸	CA12	O43570	5/20	0.33

▸	CA9	Q16790	5/20	0.33

▸	TDP1	Q9NUW8	2/20	0.32

▸	POLB	P06746	1/20	0.32

▸	NPSR1	Q6W5P4	1/20	0.32

▸	ATM	Q13315	1/20	0.31

▸	CA14	Q9ULX7	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
SCHEMBL7260637	0.89	TDP1 (0.44)	MEN1KMT2AGAACA1CA2
SCHEMBL3290477	0.80	CA1 (0.33)	MEN1KMT2AGAACA1CA2
SCHEMBL3287423	0.79	CA1 (0.37)	MEN1KMT2AGAACA1CA2
SCHEMBL6890969	0.77	TDP1 (0.33)	MEN1KMT2AGAACA1CA2
SCHEMBL3287433	0.77	CA14 (0.38)	MEN1KMT2AGAACA1CA2
SCHEMBL16349574	0.75	CA14 (0.46)	MEN1KMT2AGAACA1CA2
SCHEMBL3287420	0.72	CA1 (0.34)	MEN1KMT2AGAACA1CA2
SCHEMBL26670001	0.71	CA14 (0.53)	MEN1KMT2AGAACA1CA2
SCHEMBL7265947	0.71	—	—
SCHEMBL6888540	0.70	TDP1 (0.37)	MEN1KMT2AGAATDP1CA14

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
US-6583301-B1	Bipolar; form complexes with polyanions; delivering bioactive substances such as nucleic acids to cells in vitro and in vivo	CELLTECH R & D LIMITED (GB)	2003-06-24	—	—	US	disclosed