SCHEMBL1448411

SCHEMBL1448411

Cc1ncc(-c2ccnc(N)n2)n1CC1CCC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 3/20 0.50
CDC7 O00311 9/20 0.48
MAPK14 Q16539 1/20 0.40
DYRK3 O43781 2/20 0.39
CCNT1 O60563 2/20 0.39
CDK9 P50750 2/20 0.39
DYRK1A Q13627 2/20 0.39
DYRK2 Q92630 2/20 0.39
DYRK1B Q9Y463 2/20 0.39
MAP3K14 Q99558 1/20 0.39
CDK1 P06493 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
CCNA2 P20248 1/20 0.36
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36
ADORA2A P29274 1/20 0.36

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
SCHEMBL4030274 0.95 CDK2 (0.54) CDK2CDC7MAPK14DYRK3CCNT1
SCHEMBL4022085 0.80 CDC7 (0.51) CDK2CDC7MAPK14DYRK3CCNT1
SCHEMBL6595714 0.80 CDK2 (0.52) CDK2CDC7DYRK3CCNT1CDK9
SCHEMBL4020333 0.79 CDC7 (0.53) CDK2CDC7MAPK14DYRK3CCNT1
SCHEMBL1447222 0.76 CDK2 (0.53) CDK2CDC7MAPK14DYRK3CCNT1
SCHEMBL4022128 0.76 CDK2 (0.47) CDK2CDC7MAPK14DYRK3CCNT1
SCHEMBL27534151 0.75 CDC7 (0.54) CDK2CDC7DYRK3CCNT1CDK9
SCHEMBL6596348 0.74 DYRK1A (0.46) CDK2CDC7DYRK3CCNT1CDK9
SCHEMBL6596886 0.73 DYRK3 (0.40) CDK2CDC7DYRK3CCNT1CDK9
SCHEMBL1447097 0.73 CDC7 (0.48) CDK2CDC7DYRK3CCNT1CDK9

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
EP-2301928-A1 Imidazolyl-pyrimidine compounds for use in the treatment of proliferative disorders AstraZeneca AB (SE) 2011-03-30 EP disclosed
US-20080280906-A1 Imidazolyl-Pyrimidine Compounds for Use in the Treatment of Proliferative Disorders ASTRAZENECA AB (SE) 2008-11-13 US disclosed
EP-1912974-A1 IMIDAZOLYL-PYRIMIDINE COMPOUNDS FOR USE IN THE TREATMENT OF PROLIFERATIVE DISORDERS AstraZeneca AB (SE) 2008-04-23 EP disclosed
WO-2007015064-A1 IMIDAZOLYL-PYRIMIDINE COMPOUNDS FOR USE IN THE TREATMENT OF PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2007-02-08 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-20080280906-A1 Imidazolyl-Pyrimidine Compounds for Use in the Treatment of Proliferative Disorders CCNI, MKI67, TYMP CDK2 13/4885CDC7 112/4885MAPK14 1132/4885

“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.