SCHEMBL28073065

SCHEMBL28073065

Cc1nc(N)c2ncn([C@@H]3O[C@H](C(O)P(O)(O)=S)[C@@H](O)[C@H]3O)c2n1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RNASEL Q05823 4/20 0.51
DNMT1 P26358 1/20 0.51
DNMT3B Q9UBC3 1/20 0.51
ADORA3 P0DMS8 2/20 0.49
ADORA2A P29274 2/20 0.46
ADORA2B P29275 2/20 0.46
LMNA P02545 1/20 0.45
NT5E P21589 1/20 0.45
HIF1A Q16665 1/20 0.45

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
SCHEMBL25619503 0.85 DNMT1 (0.56) RNASELDNMT1DNMT3BADORA3ADORA2A
SCHEMBL25619482 0.85 DNMT1 (0.56) RNASELDNMT1DNMT3BADORA3ADORA2A
SCHEMBL20009824 0.79 DNMT1 (0.51) RNASELDNMT1DNMT3BADORA3ADORA2A
SCHEMBL13769821 0.79 ADORA3 (0.76) RNASELDNMT1DNMT3BADORA3ADORA2A
SCHEMBL2458451 0.78 RNASEL (0.54) RNASELDNMT1DNMT3BNT5E
SCHEMBL8426440 0.78 RNASEL (0.70) RNASELADORA3NT5E
SCHEMBL3372651 0.77 RNASEL (0.53) RNASELDNMT1DNMT3BNT5E
SCHEMBL3836258 0.77 CA5A (0.63) DNMT1DNMT3BADORA3ADORA2AADORA2B
SCHEMBL27706396 0.77 ADORA3 (0.55) RNASELDNMT1DNMT3BADORA3ADORA2A
SCHEMBL28073059 0.77 P2RY1 (0.61) LMNA

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
CN-103384496-B Blood collection device containing blood stabilizer 贝克顿·迪金森公司 2016-10-12 CN claimed