SCHEMBL4248478

SCHEMBL4248478

Cc1ncc(-c2nc(Nc3ccc(N4CCN(C(=O)[C@H](C)O)CC4)cn3)ncc2F)n1C1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 17/20 0.54
CDK6 Q00534 13/20 0.54
CCND1 P24385 9/20 0.54
CDK2 P24941 8/20 0.54
CCND3 P30281 8/20 0.54
CCNA2 P20248 7/20 0.54
CDK9 P50750 4/20 0.54
CCNT1 O60563 3/20 0.54
KCNH2 Q12809 1/20 0.50
CDK7 P50613 3/20 0.49
CCNH P51946 3/20 0.49
CDK1 P06493 3/20 0.49
CCNB1 P14635 3/20 0.49
CDK12 Q9NYV4 1/20 0.48
PIK3CD O00329 1/20 0.47
CSF1R P07333 1/20 0.47
CCND2 P30279 1/20 0.47

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
SCHEMBL4246773 0.83 CDK4 (0.62) CDK4CDK6CCND1CDK2CCND3
SCHEMBL4247804 0.83 CDK4 (0.62) CDK4CDK6CCND1CDK2CCND3
SCHEMBL3549927 0.79 CDK4 (0.61) CDK4CDK6CCND1CDK2CCND3
SCHEMBL3548645 0.77 CDK2 (0.80) CDK2KCNH2CDK1
SCHEMBL5239921 0.77 CDK2 (0.80) CDK2KCNH2CDK1
SCHEMBL3553510 0.77 CDK2 (0.80) CDK2KCNH2CDK1
SCHEMBL4254074 0.74 CDK2 (0.81) CDK4CDK6CCND1CDK2CCND3
SCHEMBL4254071 0.74 CDK2 (0.81) CDK4CDK6CCND1CDK2CCND3
SCHEMBL4408142 0.72 CDK6 (0.59) CDK4CDK6CCND1CDK2CDK1
SCHEMBL3554221 0.72 CDK2 (0.70) CDK4CDK6CCND1CDK2CCND3

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-20090233928-A1 IMIDAZOLO-5-YL-2-ANILO-PYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2009-09-17 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-20090233928-A1 IMIDAZOLO-5-YL-2-ANILO-PYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION MKI67, TYMP, PCNA CDK4 30/4885CDK6 60/4885CCND1 38/4885

“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.