SCHEMBL9851850

CCCCCCCCCCCCCCCCCC(=O)OC[C@H]1O[C@@H](n2ncc3c(=O)[nH]cnc32)[C@H](O)[C@@H]1OC(=O)CCCCCCCCCCCCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	TK2	O00142	4/20	0.42

▸	LMNA	P02545	1/20	0.38

▸	THRB	P10828	1/20	0.38

▸	SMN1; SMN2	Q16637	1/20	0.38

▸	HIF1A	Q16665	1/20	0.38

▸	CA12	O43570	5/20	0.37

▸	CA1	P00915	5/20	0.37

▸	CA2	P00918	5/20	0.37

▸	CA9	Q16790	5/20	0.37

▸	CA14	Q9ULX7	5/20	0.37

▸	ATG7	O95352	1/20	0.36

▸	GSK3A	P49840	1/20	0.35

▸	RPS6KA3	P51812	1/20	0.35

▸	MAPK14	Q16539	1/20	0.35

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
SCHEMBL9851791	1.00	TK2 (0.42)	TK2LMNATHRBSMN1; SMN2HIF1A
SCHEMBL9851891	0.93	TK2 (0.46)	TK2LMNATHRBSMN1; SMN2HIF1A
SCHEMBL9851753	0.93	TK2 (0.46)	TK2LMNATHRBSMN1; SMN2HIF1A
SCHEMBL9851734	0.93	LMNA (0.45)	TK2LMNATHRBSMN1; SMN2HIF1A
SCHEMBL9851712	0.93	LMNA (0.45)	TK2LMNATHRBSMN1; SMN2HIF1A
SCHEMBL9851694	0.92	TK2 (0.49)	TK2LMNASMN1; SMN2
SCHEMBL9851697	0.92	TK2 (0.49)	TK2LMNASMN1; SMN2
SCHEMBL9851715	0.92	ATG7 (0.44)	ATG7GSK3ARPS6KA3MAPK14
SCHEMBL9851807	0.92	ATG7 (0.44)	ATG7GSK3ARPS6KA3MAPK14
SCHEMBL9851692	0.87	TK2 (0.56)	TK2

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
EP-0450102-A1	NUCLEOSIDE DERIVATIVE	Yamasa Shoyu Kabushiki Kaisha (JP)	1991-10-09	—	—	EP	disclosed