SCHEMBL6184859

SCHEMBL6184859

COc1ccc(-c2nn3c(NC4CCCC4)cccc3c2-c2ccnc(Nc3cccc(C(=O)c4ccccc4)c3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 11/20 0.53
CDK5 Q00535 1/20 0.44
PIK3CA P42336 1/20 0.43
PIK3CB P42338 1/20 0.43
PIK3CG P48736 1/20 0.43
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
SRC P12931 1/20 0.42
SCN9A Q15858 1/20 0.41
MAPK8 P45983 2/20 0.41
MAPK9 P45984 2/20 0.41
MAPK10 P53779 1/20 0.41
CDK2 P24941 1/20 0.41
CAMKK1 Q8N5S9 1/20 0.41
CAMKK2 Q96RR4 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
SCHEMBL6338970 0.88 CDK5 (0.59) GSK3BCDK5PIK3CAPIK3CBPIK3CG
SCHEMBL6183492 0.86 GSK3B (0.51) GSK3BCDK5PIK3CAPIK3CBPIK3CG
SCHEMBL6106995 0.86 EIF2AK2 (0.50) GSK3BCDK5PIK3CAPIK3CBPIK3CG
SCHEMBL6106606 0.86 EIF2AK2 (0.50) GSK3BCDK5PIK3CAPIK3CBPIK3CG
SCHEMBL6182597 0.85 GSK3B (0.49) GSK3BCDK5PIK3CAPIK3CBPIK3CG
SCHEMBL6105305 0.85 EIF2AK2 (0.51) GSK3BCDK5PIK3CAPIK3CBPIK3CG
SCHEMBL6069055 0.85 GSK3B (0.55) GSK3BCDK5PIK3CAPIK3CBPIK3CG
SCHEMBL14592155 0.84 GSK3B (0.49) GSK3BCDK5PIK3CAPIK3CBPIK3CG
SCHEMBL6108267 0.83 GSK3B (0.51) GSK3BCDK5PIK3CAPIK3CBPIK3CG
SCHEMBL6183945 0.81 GSK3B (0.61) GSK3BCDK2

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 1270/4885CDK5 1272/4885PIK3CA 1498/4885

“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.