SCHEMBL8620002

SCHEMBL8620002

Nc1cc(C[C@]2(O)O[C@H](CO)[C@@H](O)[C@H]2O)ncn1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 3/20 0.33
DOT1L Q8TEK3 3/20 0.33
ADORA2A P29274 2/20 0.33
PI4KA P42356 2/20 0.33
PI4K2B Q8TCG2 2/20 0.33
PI4K2A Q9BTU6 2/20 0.33
PI4KB Q9UBF8 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HIF1A Q16665 2/20 0.33
DPP4 P27487 1/20 0.33
SLC28A1 O00337 1/20 0.33
MAP3K7 O43318 1/20 0.33
SLC28A2 O43868 1/20 0.33
GAPDH P04406 1/20 0.33
MAPK1 P28482 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33
STAT6 P42226 1/20 0.33
SMN1; SMN2 Q16637 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL8620005 0.71 DOT1L (0.44) ADORA3DOT1LADORA2API4KAPI4K2B
SCHEMBL12369692 0.67 MEN1 (0.38) MEN1KMT2ACDK1
SCHEMBL12459389 0.67 MEN1 (0.38) MEN1KMT2ACDK1
SCHEMBL17035749 0.67 MEN1 (0.38) MEN1KMT2A
SCHEMBL17035735 0.67 MEN1 (0.38) MEN1KMT2A
SCHEMBL16885871 0.67 MEN1 (0.38) MEN1KMT2ACDK1
SCHEMBL19088712 0.67 MEN1 (0.38) MEN1KMT2A
SCHEMBL17035756 0.67 MEN1 (0.38) MEN1KMT2A
SCHEMBL17035762 0.67 MEN1 (0.38) MEN1KMT2A
SCHEMBL15265730 0.67 MEN1 (0.51) MEN1KMT2ACDK1

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-0686150-B1 Process for the preparation of C-nucleosides and C-nucleoside analogues, new C-nucleosides and C-nucleoside analogues and their use MAX DELBRUECK CENTRUM (DE) 1998-05-20 EP disclosed