SCHEMBL4243729

SCHEMBL4243729

COC(=O)c1ccc(Nc2ncc(F)c(-c3cnc(C)n3C(C)C)n2)nc1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 16/20 0.66
KCNH2 Q12809 8/20 0.66
CDK1 P06493 7/20 0.59
CCND1 P24385 1/20 0.48
CDK6 Q00534 1/20 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
SCHEMBL4248539 0.90 CDK2 (0.68) CDK2KCNH2CDK1CCND1CDK6
SCHEMBL4251192 0.89 KCNH2 (0.79) CDK2KCNH2CDK1CDK6
SCHEMBL4248471 0.89 CDK2 (0.79) CDK2KCNH2CDK1
SCHEMBL4245337 0.88 CDK2 (0.79) CDK2KCNH2CDK1
SCHEMBL1156650 0.83 CDK2 (0.66) CDK2KCNH2CDK1
SCHEMBL4247837 0.80 CDK2 (0.57) CDK2KCNH2CDK1CCND1CDK6
SCHEMBL4244145 0.80 CDK2 (0.56) CDK2KCNH2CDK1CDK6
SCHEMBL30828143 0.80 CDK2 (0.83) CDK2KCNH2CDK1
SCHEMBL27382932 0.80 CDK2 (0.83) CDK2KCNH2CDK1
SCHEMBL1447285 0.80 CDK2 (0.76) CDK2KCNH2CDK1

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 3 patents. 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
EP-1869016-A1 IMIDAZOLO-5-YL-2-ANILO-PYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION AstraZeneca AB (SE) 2007-12-26 EP disclosed
WO-2006095159-A1 (IMIDAZOLO-5-YL)-2-ANILO-PYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2006-09-14 WO 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 CDK2 23/4885KCNH2 4185/4885CDK1 55/4885

“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.