SCHEMBL4259683

SCHEMBL4259683

Cc1ncc(-c2nc(Nc3ccc(C(=O)O)nc3)ncc2F)n1C1CCOCC1.[LiH]

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 15/20 0.48
KCNH2 Q12809 8/20 0.48
CDK1 P06493 7/20 0.45
JAK2 O60674 1/20 0.43
MAPK8 P45983 1/20 0.41
MAPK9 P45984 1/20 0.41
MAPK10 P53779 1/20 0.41
MAPK14 Q16539 1/20 0.41

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
SCHEMBL14093058 0.99 CDK2 (0.49) CDK2KCNH2CDK1JAK2MAPK8
SCHEMBL14093057 0.92 CDK2 (0.49) CDK2KCNH2CDK1JAK2
Lithium Ion SCHEMBL4259673 0.90 CDK2 (0.47) CDK2KCNH2CDK1JAK2
SCHEMBL4260947 0.90 CDK2 (0.47) CDK2KCNH2CDK1JAK2MAPK8
SCHEMBL4243943 0.89 CDK2 (0.53) CDK2KCNH2CDK1JAK2
SCHEMBL4266036 0.89 CDK2 (0.50) CDK2KCNH2CDK1JAK2
SCHEMBL13879010 0.88 CDK2 (0.54) CDK2KCNH2CDK1JAK2
SCHEMBL4408272 0.88 CDK2 (0.51) CDK2KCNH2CDK1JAK2
SCHEMBL4259586 0.88 CDK2 (0.48) CDK2KCNH2CDK1JAK2
SCHEMBL4258937 0.88 CDK2 (0.45) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046782-A2 IMIDAZOLYLPYRIMIDINE DERIVATIVES FOR TREATMENT OF DISEASES RELATED TO GLYCOGEN SYNTHASE KINASE (GSK3) Astra Zeneca AB (SE) 2009-04-15 EP claimed
WO-2008002244-A2 IMIDAZOL-PYRIMIDINE DERIVATIVES FOR TREATMENT OF DISEASES RELATED TO GLYCOGEN SYNTHASE KINASE (GSK3) ASTRAZENECA AB (SE) 2008-01-03 WO claimed
EP-2046782-A2 IMIDAZOLYLPYRIMIDINE DERIVATIVES FOR TREATMENT OF DISEASES RELATED TO GLYCOGEN SYNTHASE KINASE (GSK3) Astra Zeneca AB (SE) 2009-04-15 EP disclosed
US-20080188502-A1 New Compounds I ASTRAZENECA AB (SE) 2008-08-07 US disclosed
WO-2008002244-A2 IMIDAZOL-PYRIMIDINE DERIVATIVES FOR TREATMENT OF DISEASES RELATED TO GLYCOGEN SYNTHASE KINASE (GSK3) ASTRAZENECA AB (SE) 2008-01-03 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-20080188502-A1 New Compounds I SLC10A1, REN, SLC5A1 CDK2 3536/4885KCNH2 741/4885CDK1 2357/4885

“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.