SCHEMBL16271095

SCHEMBL16271095

CC(C)[Si]1(C(C)C)OC[C@@H]2O[C@H](n3cnc4c(N=N)ncnc43)CC2O[Si](C(C)C)(C(C)C)O1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 2/20 0.38
▸ HIF1A Q16665 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.32
▸ ADA P00813 1/20 0.31
▸ CYP2C19 P33261 1/20 0.30

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL12222444 0.85 STING1 (0.52) STING1ADORA3ADA
SCHEMBL12595500 0.85 STING1 (0.52) STING1ADORA3ADA
SCHEMBL12729578 0.85 STING1 (0.52) STING1ADORA3ADA
SCHEMBL12352439 0.85 STING1 (0.52) STING1ADORA3ADA
SCHEMBL17772331 0.85 STING1 (0.52) STING1ADORA3ADA
SCHEMBL8624094 0.85 STING1 (0.52) STING1ADORA3ADA
SCHEMBL16271094 0.82 PDE4A (0.42) STING1ADORA3
SCHEMBL12595405 0.81 STING1 (0.32) STING1
SCHEMBL21049964 0.78 STING1 (0.49) STING1
SCHEMBL17037317 0.78 STING1 (0.49) STING1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1431304-B1 Beta - L-2'-Deoxy-Nucleosides for the treatment of Hepatitis B NOVARTIS AG (CH) 2014-12-03 — — EP disclosed
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