SCHEMBL20547915

CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](OP(=O)(OCCC#N)OC[C@H]2O[C@@H](n3cnc4c(=O)n5cc[nH]c5nc43)[C@H](O[PH](=O)O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@@H](CO)O[C@H]1n1cnc2c(NC(=O)c3ccccc3)ncnc21

nearest known ligand 0.36

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	P2RY12	Q9H244	12/20	0.36

▸	DNPH1	O43598	2/20	0.34

▸	P2RY2	P41231	1/20	0.34

▸	P2RY1	P47900	1/20	0.34

▸	P2RY6	Q15077	1/20	0.34

▸	PRMT6	Q96LA8	1/20	0.34

▸	ADORA1	P30542	1/20	0.33

▸	GAPDH	P04406	1/20	0.33

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
SCHEMBL20547951	0.93	P2RY12 (0.35)	P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL20548026	0.90	P2RY12 (0.35)	P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL17860584	0.89	P2RY12 (0.39)	P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL21137419	0.89	P2RY12 (0.38)	P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL31637437	0.89	P2RY12 (0.38)	P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL21073931	0.89	P2RY12 (0.38)	P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL20547957	0.88	P2RY12 (0.33)	P2RY12P2RY2P2RY1P2RY6PRMT6
SCHEMBL17860533	0.88	P2RY12 (0.39)	P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL19762770	0.86	P2RY12 (0.41)	P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL17860551	0.86	P2RY12 (0.38)	P2RY12DNPH1P2RY2P2RY1P2RY6

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
WO-2018198084-A1	CYCLIC DI-NUCLEOTIDE COMPOUNDS WITH TRICYCLIC NUCLEOBASES	LUPIN LIMITED (IN)	2018-11-01	—	—	WO	disclosed