SCHEMBL4195833

SCHEMBL4195833

Cc1ncc(-c2nc(NC3CCN(S(C)(=O)=O)CC3)ncc2F)n1C(C)C

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 12/20 0.61
CCNE1 P24864 6/20 0.61
CDK1 P06493 5/20 0.61
CCNB2 O95067 1/20 0.61
CCNE2 O96020 1/20 0.61
CCNB1 P14635 1/20 0.61
CDK5 Q00535 1/20 0.61
CDK5R1 Q15078 1/20 0.61
CCNB3 Q8WWL7 1/20 0.61
CDK4 P11802 9/20 0.56
CCND1 P24385 9/20 0.56
CDK6 Q00534 9/20 0.56
CCNT1 O60563 1/20 0.56
CDK9 P50750 1/20 0.56
CCND3 P30281 8/20 0.51
KCNH2 Q12809 1/20 0.50

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
SCHEMBL4495234 0.88 CCNE1 (0.61) CDK2CCNE1CDK1CCNB2CCNE2
SCHEMBL4199394 0.88 CDK2 (0.51) CDK2CCNE1CDK1CCNB2CCNE2
SCHEMBL4495143 0.88 CDK2 (0.60) CDK2CCNE1CDK1CCNB2CCNE2
SCHEMBL4202924 0.87 CDK2 (0.51) CDK2CCNE1CDK1CCNB2CCNE2
SCHEMBL4196282 0.87 CDK2 (0.51) CDK2CCNE1CDK1CCNB2CCNE2
SCHEMBL4517199 0.86 CDK2 (0.49) CDK2CCNE1CDK1CCNB2CCNE2
SCHEMBL4500160 0.85 CCNE1 (0.62) CDK2CCNE1CDK1CCNB2CCNE2
SCHEMBL4206968 0.85 CDK2 (0.51) CDK2CCNE1CDK1CCNB2CCNE2
SCHEMBL3214604 0.84 KCNH2 (0.52) CDK2CCNE1CDK1CCNB2CCNE2
SCHEMBL3214611 0.84 KCNH2 (0.52) CDK2CCNE1CDK1CCNB2CCNE2

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 4 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 claimed
EP-2032559-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION AstraZeneca AB (SE) 2009-03-11 EP claimed
WO-2007138268-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2007-12-06 WO claimed
US-20090275567-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2009-11-05 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-20090275567-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION CCNI, MKI67, CDK2 CDK2 3/4885CCNE1 17/4885CDK1 22/4885

“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.