SCHEMBL20547882

CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H]2O[Si](C(C)(C)C)(C(C)(C)C)OC[C@H]2O[C@H]1n1cnc2c(=O)n(N)c(N)nc21

nearest known ligand 0.40

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	STING1	Q86WV6	14/20	0.38

▸	PDE3B	Q13370	1/20	0.33

▸	PDE3A	Q14432	1/20	0.33

▸	ALDH1A1	P00352	1/20	0.32

▸	MEN1	O00255	1/20	0.31

▸	KMT2A	Q03164	1/20	0.31

▸	RXFP1	Q9HBX9	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
SCHEMBL20547506	0.87	STING1 (0.51)	STING1PDE3BPDE3A
SCHEMBL20547866	0.85	STING1 (0.34)	STING1
SCHEMBL20547719	0.85	STING1 (0.34)	STING1
SCHEMBL20547765	0.85	STING1 (0.35)	STING1PDE3BPDE3AALDH1A1
SCHEMBL20548261	0.83	STING1 (0.43)	STING1PDE3BPDE3AALDH1A1MEN1
SCHEMBL17363529	0.82	PDE4A (0.44)	STING1PDE3AKMT2ARXFP1
SCHEMBL17363528	0.82	PDE4A (0.44)	STING1PDE3AKMT2ARXFP1
SCHEMBL11986885	0.81	STING1 (0.33)	STING1
SCHEMBL20547861	0.80	STING1 (0.41)	STING1PDE3BPDE3AALDH1A1MEN1
SCHEMBL19689068	0.79	STING1 (0.38)	STING1PDE3AKMT2ARXFP1

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