SCHEMBL5083016

SCHEMBL5083016

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

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 10/20 0.33
CDK5R1 Q15078 10/20 0.33
CDK1 P06493 6/20 0.32
CCNB1 P14635 6/20 0.32
CCNB2 O95067 5/20 0.32
CCNB3 Q8WWL7 5/20 0.32
SERPINA3 P01011 1/20 0.31
CCNE2 O96020 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
HPRT1 P00492 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
SCHEMBL5086060 0.94 SERPINA3 (0.32) CDK5CDK5R1CDK1CCNB1CCNB2
SCHEMBL5082999 0.87 HPRT1 (0.40) CDK5CDK5R1CDK1CCNB1CCNB2
SCHEMBL5080106 0.87
SCHEMBL5082981 0.86 CCNE2 (0.34) CDK5CDK5R1CDK1CCNB1CCNB2
SCHEMBL5082395 0.81 CDK1 (0.35) CDK5CDK5R1CDK1CCNB1CCNB2
SCHEMBL5082380 0.80 HPRT1 (0.38) CDK5CDK5R1CDK1CCNB1CCNB2
SCHEMBL5082974 0.80 CCNE2 (0.32) CDK5CDK5R1CDK1CCNB1CCNB2
SCHEMBL5086364 0.80 CCNE1 (0.32) CDK5CDK5R1CDK1CCNB1CCNB2
SCHEMBL5086113 0.79 HPRT1 (0.35) CDK5CDK5R1CDK1CCNB1CCNB2
SCHEMBL5080057 0.79 CCNE1 (0.36) CDK5CDK5R1CDK1CCNB1CCNB2

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 CDK5 2538/4885CDK5R1 2630/4885CDK1 704/4885

“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.