SCHEMBL4992467

SCHEMBL4992467

Cc1ncc(-c2nc(Nc3ccc(CN4CCCC(CO)C4)nc3)ncc2F)n1C1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 13/20 0.43
KCNH2 Q12809 6/20 0.43
CDK1 P06493 8/20 0.38
JAK2 O60674 2/20 0.36
PRKCQ Q04759 1/20 0.36
CDK4 P11802 1/20 0.36
CCNB1 P14635 1/20 0.36
CCNE1 P24864 1/20 0.36
JAK1 P23458 1/20 0.35
JAK3 P52333 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35

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
SCHEMBL14092821 0.91 CDK2 (0.46) CDK2KCNH2CDK1JAK2CDK4
SCHEMBL4435674 0.90 CDK2 (0.49) CDK2KCNH2CDK1JAK2CDK4
SCHEMBL4433038 0.90 CDK2 (0.49) CDK2KCNH2CDK1JAK2CDK4
SCHEMBL4434460 0.89 CDK2 (0.48) CDK2KCNH2CDK1JAK2CDK4
SCHEMBL4430574 0.88 CDK2 (0.49) CDK2KCNH2CDK1JAK2CDK4
SCHEMBL3939760 0.88 CDK2 (0.51) CDK2KCNH2CDK1JAK2CDK4
SCHEMBL4432737 0.86 CDK2 (0.45) CDK2KCNH2CDK1CDK4
SCHEMBL4436531 0.85 CDK2 (0.47) CDK2KCNH2CDK1JAK2CDK4
SCHEMBL4430807 0.85 CDK2 (0.45) CDK2KCNH2CDK1
SCHEMBL4438545 0.84 CDK2 (0.44) CDK2KCNH2CDK1JAK2CDK4

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
US-20080188503-A1 5-Fluoro-4-[2-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-imidazol-5-yl]-N-pyrimidin-5-ylpyrimidin-2-amine; Alzheimer's Disease (AD) Dementias, and Taupathies; GSK3 inhibitors in inflammatory diseases ASTRAZENACA AB (SE) 2008-08-07 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-20080188503-A1 5-Fluoro-4-[2-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-imidazol-5-yl]-N-pyrimidin-5-ylpyrimidin-2-amine; Alzheimer's Disease (AD) Dementias, and Taupathies; GSK3 inhibitors in inflammatory diseases GSK3B, GSK3A, MAPT CDK2 328/4885KCNH2 3601/4885CDK1 145/4885

“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.