SCHEMBL4203202

SCHEMBL4203202

Cc1ncc(-c2nc(NC3CCCCN(C(=O)OC(C)(C)C)C3)ncc2F)n1C(C)C

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 2/20 0.54
CCND1 P24385 2/20 0.54
CCND3 P30281 2/20 0.54
CDK6 Q00534 2/20 0.54
CDK2 P24941 15/20 0.53
CDK1 P06493 7/20 0.53
KCNH2 Q12809 8/20 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
SCHEMBL4490411 0.88 CDK2 (0.57) CDK4CCND1CCND3CDK6CDK2
SCHEMBL4517014 0.84 CDK2 (0.69) CDK2CDK1KCNH2
SCHEMBL4504492 0.82 CDK2 (0.54) CDK4CCND1CCND3CDK6CDK2
SCHEMBL4515739 0.78 CDK2 (0.61) CDK4CCND1CCND3CDK6CDK2
SCHEMBL31000111 0.76 CDK4 (0.40) CDK4CCND1CCND3CDK6CDK2
SCHEMBL31000255 0.75 CDK4 (0.41) CDK4CCND1CCND3CDK6CDK2
SCHEMBL4494755 0.75 CDK2 (0.52) CDK2CDK1KCNH2
SCHEMBL23003022 0.74 CDK2 (0.64) CDK4CCND1CDK6CDK2
SCHEMBL23063745 0.74 CDK2 (0.64) CDK4CCND1CDK6CDK2
SCHEMBL23003024 0.74 CDK2 (0.64) CDK4CCND1CDK6CDK2

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-20090275567-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2009-11-05 US disclosed
EP-2032559-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION AstraZeneca AB (SE) 2009-03-11 EP disclosed
WO-2007138268-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2007-12-06 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-20090275567-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION CCNI, MKI67, CDK2 CDK4 9/4885CCND1 21/4885CCND3 50/4885

“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.