SCHEMBL6904115

SCHEMBL6904115

[O]CC(CCO)n1cnc2c(-n3cccc3)ncnc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AHCY P23526 3/20 0.33
FDPS P14324 1/20 0.32
ADORA2A P29274 2/20 0.32
ADORA2B P29275 2/20 0.32
ADORA1 P30542 2/20 0.32
PI4KA P42356 1/20 0.31
PI4K2B Q8TCG2 1/20 0.31
PI4K2A Q9BTU6 1/20 0.31
PI4KB Q9UBF8 1/20 0.31
CCNB2 O95067 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
CCNB3 Q8WWL7 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL6693825 0.90 AHCY (0.34) AHCYADORA2AADORA2BADORA1PI4KA
SCHEMBL6697105 0.85 AHCY (0.36) AHCYFDPSADORA2AADORA2BADORA1
SCHEMBL6903285 0.81 HPRT1 (0.45) AHCYFDPS
SCHEMBL6693455 0.79 AHCY (0.36) AHCYADORA2AADORA2BADORA1PI4KA
SCHEMBL6691673 0.78 AHCY (0.35) AHCYADORA2AADORA2BADORA1PI4KA
SCHEMBL6904695 0.74 FGFR1 (0.42) AHCYFDPS
SCHEMBL6904198 0.71 AHCY (0.33) AHCY
SCHEMBL6693196 0.70 ADORA2A (0.52) AHCYADORA2AADORA2BADORA1PI4KA
SCHEMBL5080086 0.70 ADORA2A (0.59) AHCYADORA2AADORA2BADORA1PI4KA
SCHEMBL6693460 0.68 AHCY (0.37) AHCYADORA2AADORA2BADORA1PI4KA

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
US-20040014722-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. 2004-01-22 US claimed
US-20040014722-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. 2004-01-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040014722-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases NSUN2, POLR2H, NSUN3 AHCY 921/4885FDPS 3139/4885ADORA2A 2690/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.