SCHEMBL16349867

Cc1cn([C@H]2C[C@@H](OC(=O)CCCCC(=O)O[C@@H]3C[C@H](n4cc(C)c(=O)[nH]c4=O)O[C@@H]3CO)[C@@H](CO)O2)c(=O)[nH]c1=O

nearest known ligand 0.71

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	RNASE1	P07998	1/20	0.71

▸	SLC6A2	P23975	1/20	0.65

▸	TK2	O00142	3/20	0.61

▸	TK1	P04183	2/20	0.59

▸	ABCG2	Q9UNQ0	3/20	0.58

▸	ABCB1	P08183	1/20	0.58

▸	ALB	P02768	1/20	0.57

▸	PKM	P14618	1/20	0.57

▸	LMNA	P02545	1/20	0.57

▸	BLM	P54132	1/20	0.57

▸	PMP22	Q01453	1/20	0.57

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
SCHEMBL13901238	1.00	RNASE1 (0.71)	RNASE1SLC6A2TK2TK1ABCG2
SCHEMBL8999382	0.95	TK2 (0.67)	RNASE1SLC6A2TK2TK1ABCG2
SCHEMBL19407973	0.92	RNASE1 (0.71)	RNASE1SLC6A2TK2TK1ALB
SCHEMBL16287348	0.92	RNASE1 (0.68)	RNASE1SLC6A2TK2TK1ALB
SCHEMBL767324	0.92	RNASE1 (0.68)	RNASE1SLC6A2TK2TK1ALB
SCHEMBL774263	0.92	RNASE1 (0.68)	RNASE1SLC6A2TK2TK1ALB
SCHEMBL3337696	0.92	RNASE1 (0.71)	RNASE1SLC6A2TK2TK1ALB
SCHEMBL14681227	0.92	RNASE1 (0.68)	RNASE1SLC6A2TK2TK1ALB
SCHEMBL1146086	0.91	RNASE1 (0.60)	RNASE1SLC6A2TK2TK1ABCG2
SCHEMBL27790846	0.90	SLC6A2 (0.64)	RNASE1SLC6A2TK2TK1ABCG2

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-7507859-B2	Functional synthetic molecules and macromolecules for gene delivery	FIFTH BASE LLC (US)	2009-03-24	—	—	US	disclosed