SCHEMBL4074993

COc1ccc(C(OC[C@]23CO[C@H]([C@H](n4ccc(=O)[nH]c4=O)O2)[C@H]3O[Si](C)(C)C(C)(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	DUT	P33316	8/20	0.34

▸	TYMP	P19971	1/20	0.33

▸	THRB	P10828	1/20	0.32

▸	P2RY14	Q15391	1/20	0.32

▸	P2RY6	Q15077	1/20	0.32

▸	NT5E	P21589	1/20	0.32

▸	SLC6A1	P30531	2/20	0.31

▸	SLC6A11	P48066	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
SCHEMBL1098282	0.87	P2RY6 (0.38)	DUTTYMPP2RY14P2RY6NT5E
SCHEMBL4074748	0.87	P2RY6 (0.38)	DUTTYMPP2RY14P2RY6NT5E
SCHEMBL4074704	0.87	TYMP (0.33)	TYMPTHRBSLC6A1SLC6A11
SCHEMBL7096692	0.81	P2RY6 (0.41)	DUTTYMPP2RY14P2RY6NT5E
SCHEMBL12386210	0.81	P2RY6 (0.41)	DUTTYMPP2RY14P2RY6NT5E
SCHEMBL25397674	0.81	DUT (0.38)	DUTTYMPTHRBP2RY14NT5E
SCHEMBL17512839	0.81	DUT (0.38)	DUTTYMPTHRBP2RY14NT5E
SCHEMBL17512837	0.81	DUT (0.38)	DUTTYMPTHRBP2RY14NT5E
SCHEMBL13722260	0.80	DUT (0.42)	DUTP2RY14P2RY6
SCHEMBL22068879	0.80	TYMP (0.34)	DUTTYMPTHRBP2RY14NT5E

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-7569686-B1	Compounds and methods for synthesis of bicyclic nucleic acid analogs	ISIS PHARMACEUTICALS, INC. (US)	2009-08-04	—	—	US	disclosed