SCHEMBL5083541

SCHEMBL5083541

C=C(CCOCP(=O)(O)O)n1cnc2c(NOC)nc(C(c3ccccc3)(c3ccccc3)c3ccccc3)nc21

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NT5E P21589 11/20 0.33
FGFR1 P11362 1/20 0.33
SLC22A6 Q4U2R8 1/20 0.33
ADORA3 P0DMS8 4/20 0.31
ADORA2A P29274 2/20 0.31
ADORA1 P30542 2/20 0.31
PNP P00491 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
SCHEMBL5080071 0.89 CDK1 (0.31)
SCHEMBL5086113 0.82 HPRT1 (0.35) NT5E
SCHEMBL5082999 0.81 HPRT1 (0.40) NT5E
SCHEMBL5082380 0.80 HPRT1 (0.38) NT5EFGFR1SLC22A6
SCHEMBL5086138 0.79 HPRT1 (0.44)
SCHEMBL5085976 0.77 HPRT1 (0.32) NT5EADORA3
SCHEMBL5080084 0.76 HPRT1 (0.35) NT5E
SCHEMBL5082371 0.75 CDK1 (0.33) NT5E
SCHEMBL5082395 0.72 CDK1 (0.35)
SCHEMBL5080057 0.70 CCNE1 (0.36)

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-7388002-B2 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2008-06-17 US disclosed
US-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2006-06-08 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-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases POLR2H, NSUN2, POLR2E NT5E 1175/4885FGFR1 3600/4885SLC22A6 1753/4885

“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.