SCHEMBL3989523

SCHEMBL3989523

OC[C@H]1O[C@@H](n2cnc3c2=NCN(c2cccc(F)c2)C=3O)[C@H](O)[C@@H]1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 2/20 0.45
ADORA2A P29274 3/20 0.45
ADORA3 P0DMS8 1/20 0.45
ADORA1 P30542 1/20 0.45
ADORA2B P29275 1/20 0.45
LMNA P02545 2/20 0.42
NT5E P21589 1/20 0.42
HIF1A Q16665 1/20 0.42
ADK P55263 1/20 0.42
ALDH1A1 P00352 2/20 0.41
TP53 P04637 2/20 0.41
HTT P42858 2/20 0.41
BLM P54132 2/20 0.41
GMNN O75496 1/20 0.41
NFKB1 P19838 1/20 0.41
DNMT1 P26358 1/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
RAB9A P51151 1/20 0.41
HBB P68871 1/20 0.41

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
SCHEMBL9673734 0.78 ADORA2A (0.51) SLC29A1ADORA2AADORA3ADORA1ADORA2B
SCHEMBL41683 0.78 KDM4E (0.47) SLC29A1ADORA2AADORA3ADORA1ADORA2B
SCHEMBL3819352 0.77 SLC29A1 (0.47) SLC29A1ADORA2AADORA3ADORA1ADORA2B
SCHEMBL6137853 0.77 ALDH1A1 (0.46) SLC29A1ADORA2AADORA3ADORA1ADORA2B
SCHEMBL9671653 0.76 ADORA2A (0.49) SLC29A1ADORA2AADORA3ADORA1ADORA2B
SCHEMBL9671648 0.76 ADORA2A (0.48) SLC29A1ADORA2AADORA3ADORA1ADORA2B
SCHEMBL9670839 0.75 ADORA2A (0.42) SLC29A1ADORA2AADORA3ADORA1ADORA2B
SCHEMBL9670914 0.74 ADORA2A (0.44) SLC29A1ADORA2AADORA3ADORA1ADORA2B
SCHEMBL9670813 0.74 ADORA2A (0.49) SLC29A1ADORA2AADORA3ADORA1ADORA2B
SCHEMBL8029815 0.74 ALDH1A1 (0.43) SLC29A1ADORA2AADORA3ADORA1ADORA2B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2061316-A2 AZOLE NUCLEOSIDES AND USE AS INHIBITORS OF RNA AND DNA VARIAL POLYMERASES Southern Research Institute (US) 2009-05-27 EP claimed
WO-2008067002-A2 AZOLE NUCLEOSIDES AND USE AS INHIBITORS OF RNA AND DNA VARIAL POLYMERASES SOUTHERN RESEARCH INSTITUTE (US) 2008-06-05 WO claimed