SCHEMBL6183945

SCHEMBL6183945

Fc1ccc(-c2nn3c(NC4CCCC4)cccc3c2-c2ccnc(Nc3ccccc3)n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 15/20 0.61
CDK2 P24941 1/20 0.51
MAPK14 Q16539 4/20 0.49
MAPK13 O15264 1/20 0.47
MAPK12 P53778 1/20 0.47
MAPK11 Q15759 1/20 0.47

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
SCHEMBL6184465 0.96 GSK3B (0.55) GSK3BCDK2MAPK14
SCHEMBL5462495 0.92 GSK3B (0.55) GSK3BCDK2MAPK14MAPK13MAPK12
SCHEMBL5456838 0.91 CSNK1D (0.51) GSK3BMAPK14MAPK13MAPK12MAPK11
SCHEMBL6184717 0.91 GSK3B (0.56) GSK3BCDK2MAPK14MAPK13MAPK12
SCHEMBL6069055 0.90 GSK3B (0.55) GSK3B
SCHEMBL5462491 0.90 CSNK1D (0.51) GSK3BMAPK14MAPK13MAPK12MAPK11
SCHEMBL5453810 0.89 GSK3B (0.59) GSK3BCDK2MAPK14MAPK13MAPK12
SCHEMBL5355432 0.87 GSK3B (0.46) GSK3BCDK2
SCHEMBL6105435 0.86 MAPK10 (0.52) GSK3BCDK2MAPK14
SCHEMBL5454714 0.85 MAPK14 (0.47) GSK3BMAPK14MAPK13MAPK12MAPK11

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1341788-B1 PYRAZOLOPYRIDINES GLAXO GROUP LTD (GB) 2005-08-10 EP claimed
US-20040072853-A1 Therapeutic compounds CHAMBERLAIN STANLEY D (US) 2004-04-15 US claimed
US-7160897-B2 Therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-01-09 US disclosed
US-7160897-B2 Therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-01-09 US disclosed
EP-1341788-B1 PYRAZOLOPYRIDINES GLAXO GROUP LTD (GB) 2005-08-10 EP disclosed
US-6919352-B2 Pyrazolopyridinyl pyridine and pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2005-07-19 US disclosed
US-20040072853-A1 Therapeutic compounds CHAMBERLAIN STANLEY D (US) 2004-04-15 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-20040072853-A1 Therapeutic compounds PCSK9, ABCB1, FURIN GSK3B 1270/4885CDK2 1885/4885MAPK14 4359/4885

“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.