SCHEMBL5368162

SCHEMBL5368162

COP(=O)(CCCc1nc2nc(CCC3CCCCC3)nc(N)c2[nH]1)OC

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 3/20 0.36
CDK2 P24941 3/20 0.36
CDK1 P06493 2/20 0.36
CCNB1 P14635 2/20 0.36
HRH4 Q9H3N8 1/20 0.33
PI4KA P42356 1/20 0.32
PI4K2B Q8TCG2 1/20 0.32
PI4K2A Q9BTU6 1/20 0.32
PI4KB Q9UBF8 1/20 0.32

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
SCHEMBL4956727 0.77 CCNA2 (0.39) CCNA2CDK2CDK1CCNB1HRH4
SCHEMBL4956728 0.77 CCNA2 (0.39) CCNA2CDK2CDK1CCNB1HRH4
SCHEMBL4958939 0.76 HRH4 (0.36) CCNA2CDK2CDK1CCNB1HRH4
SCHEMBL5358288 0.73 ALDH1A1 (0.34) CCNA2CDK2CDK1CCNB1HRH4
SCHEMBL5366207 0.72 HRH4 (0.39) CCNA2CDK2CDK1CCNB1HRH4
SCHEMBL4954191 0.72 HRH4 (0.39) CCNA2CDK2CDK1CCNB1HRH4
SCHEMBL4954810 0.72 CCNA2 (0.36) CCNA2CDK2CDK1CCNB1HRH4
SCHEMBL20404186 0.67 CYP1A2 (0.47)
Hydrochloric Acid SCHEMBL17186497 0.60 PNP (0.51)
SCHEMBL5373078 0.59 METAP1 (0.32)

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-7285543-B2 Purine inhibitors of fructose-1,6-bisphosphatase METABASIS THERAPEUTICS, INC. (US) 2007-10-23 US disclosed
US-20050277619-A1 Novel purine inhibitors of fructose-1,6-bisphosphatase DANG QUN 2005-12-15 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-20050277619-A1 Novel purine inhibitors of fructose-1,6-bisphosphatase FBP1, PNP, PPA1 CCNA2 3629/4885CDK2 1590/4885CDK1 956/4885

“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.