SCHEMBL18559128

SCHEMBL18559128

Nc1nc2c(ncn2[C@@H]2O[C@@]3(CO)CC[C@@H]2[C@@H]3O)c(=O)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.54
▸ STING1 Q86WV6 3/20 0.47
▸ PDE3B Q13370 1/20 0.47
▸ PDE3A Q14432 1/20 0.47
▸ HINT1 P49773 1/20 0.46
▸ NT5E P21589 1/20 0.46
▸ PNP P00491 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ GSK3A P49840 2/20 0.43
▸ RPS6KA3 P51812 2/20 0.43
▸ MAPK14 Q16539 2/20 0.43

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
SCHEMBL15678113 1.00 ADORA3 (0.54) ADORA3STING1PDE3BPDE3AHINT1
SCHEMBL22266777 0.90 ADORA3 (0.50) ADORA3STING1PDE3BPDE3AHINT1
SCHEMBL18605977 0.85 ADORA3 (0.49) ADORA3STING1PDE3BPDE3AHINT1
SCHEMBL25758007 0.84 ADORA3 (0.52) ADORA3STING1PDE3BPDE3AHINT1
SCHEMBL5995487 0.84 ADORA3 (0.52) ADORA3STING1PDE3BPDE3AHINT1
SCHEMBL15677960 0.83 POLG (0.51) STING1PDE3BPDE3ANT5EPNP
SCHEMBL24703672 0.82 ADORA3 (0.54) ADORA3STING1PDE3BPDE3AHINT1
SCHEMBL15677988 0.82 ADORA3 (0.54) ADORA3STING1PDE3BPDE3AHINT1
SCHEMBL3033632 0.82 ADORA3 (0.54) ADORA3STING1PDE3BPDE3AHINT1
SCHEMBL14946338 0.82 ADORA3 (0.54) ADORA3STING1PDE3BPDE3AHINT1

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
US-9580708-B2 Multimeric oligonucleotides compounds RANA THERAPEUTICS, INC. (US) 2017-02-28 — — US disclosed
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