SCHEMBL29138710

SCHEMBL29138710

C#CCn1cnc2nc(N)n(O)c(=O)c21

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 4/20 0.44
RXFP1 Q9HBX9 1/20 0.33
GLA P06280 1/20 0.32
BLM P54132 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
PARN O95453 1/20 0.30
CNOT7 Q9UIV1 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
SCHEMBL14321807 0.79 ADORA2B (0.45) ADORA2BRXFP1KDM4EALDH1A1PARN
SCHEMBL29601416 0.72 ADORA2B (0.40) ADORA2B
SCHEMBL29601209 0.66 ADORA2B (0.39) ADORA2B
SCHEMBL22912677 0.66 ADORA2B (0.39) ADORA2B
SCHEMBL29601775 0.64 ADORA2B (0.40) ADORA2B
SCHEMBL29601503 0.64 ADORA2B (0.38) ADORA2B
SCHEMBL6270755 0.63 ADORA2B (0.46) ADORA2BKDM4EALDH1A1
Acetic Acid SCHEMBL1404467 0.62 ADORA2A (0.41) ADORA2BRXFP1KDM4ERAB9AKMT2A
SCHEMBL316930 0.62 ADORA2B (0.62) ADORA2BGLABLM
SCHEMBL2732871 0.61 PDE4A (0.45) ADORA2BBLMKDM4EMEN1ALDH1A1

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-115867670-A Base-modified nucleotides as substrates for TDT-based enzyme nucleic acids 伊鲁米纳新加坡有限公司 2023-03-28 CN disclosed