SCHEMBL4246771

SCHEMBL4246771

Cc1ncc(-c2ccnc(Nc3ccc(N4CCNCC4)cn3)n2)n1C(C)C.Cc1ncc(C=CC(=O)N(C)C)n1C(C)C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 9/20 0.54
CCND1 P24385 9/20 0.54
CDK6 Q00534 6/20 0.54
CDK1 P06493 4/20 0.54
CCNB1 P14635 4/20 0.54
CDK2 P24941 11/20 0.51
CCNA2 P20248 4/20 0.51
CCNA1 P78396 2/20 0.51
KCNH2 Q12809 4/20 0.49
CCNT1 O60563 2/20 0.48
CCND3 P30281 2/20 0.48
CDK7 P50613 2/20 0.48
CDK9 P50750 2/20 0.48
CCNH P51946 2/20 0.48

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
SCHEMBL4254089 0.86 CDK4 (0.68) CDK4CCND1CDK6CDK1CCNB1
SCHEMBL4254071 0.77 CDK2 (0.81) CDK4CCND1CDK6CDK1CCNB1
SCHEMBL4254074 0.77 CDK2 (0.81) CDK4CCND1CDK6CDK1CCNB1
SCHEMBL3548674 0.76 CDK2 (0.80) CDK4CCND1CDK6CDK1CCNB1
SCHEMBL27701541 0.76 CDK2 (0.62) CDK4CCND1CDK6CDK1CCNB1
SCHEMBL4255345 0.74 CDK2 (0.79) CDK4CCND1CDK6CDK1CCNB1
SCHEMBL5380216 0.72 CDK2 (0.72) CDK4CCND1CDK6CDK1CCNB1
SCHEMBL4245323 0.72 CDK4 (0.62) CDK4CCND1CDK6CDK1CCNB1
SCHEMBL4246292 0.71 CDK2 (0.67) CDK4CCND1CDK6CDK1CCNB1
SCHEMBL4248546 0.70 CDK2 (0.37) CDK2KCNH2

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 30/4885CCND1 38/4885CDK6 60/4885

“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.