SCHEMBL6487352

SCHEMBL6487352

CCOC(OCC)(OCC)c1ccc2c(-c3ccnc(NC4CC4)n3)c(-c3ccc(OC)cc3)nn2c1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 7/20 0.42
CDK4 P11802 5/20 0.41
KDR P35968 2/20 0.41
EIF2AK2 P19525 1/20 0.39
MAPK8 P45983 1/20 0.38
MAPK9 P45984 1/20 0.38
MKNK1 Q9BUB5 2/20 0.37
CSNK1D P48730 1/20 0.37
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37

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
SCHEMBL6488212 0.88 GSK3B (0.50) GSK3BCDK4KDREIF2AK2MKNK1
SCHEMBL5875496 0.88 CSNK1D (0.45) GSK3BCDK4MAPK8MAPK9CSNK1D
SCHEMBL6500869 0.85 CDK4 (0.42) GSK3BCDK4KDRMAPK8MAPK9
SCHEMBL6498415 0.82 MAPK8 (0.46) GSK3BCDK4KDREIF2AK2MAPK8
SCHEMBL6501882 0.78 MAPK8 (0.43) GSK3BCDK4MAPK8MAPK9
SCHEMBL5388522 0.77 MAPK14 (0.56) GSK3BCDK4MAPK8MAPK9CSNK1D
SCHEMBL5875531 0.74 MAPK14 (0.54) GSK3BCDK4MAPK8MAPK9CSNK1D
SCHEMBL5214934 0.74 EIF2AK2 (0.51) GSK3BCDK4EIF2AK2MAPK8MAPK9
SCHEMBL6108267 0.74 GSK3B (0.51) GSK3BCDK4KDREIF2AK2MKNK1
SCHEMBL5220849 0.74 EIF2AK2 (0.50) GSK3BEIF2AK2MAPK8MAPK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050107400-A1 Use of pyrazolopyridines as therapeutic compounds SMITHKLINE BEECHAM CORPORATION 2005-05-19 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-20050107400-A1 Use of pyrazolopyridines as therapeutic compounds QDPR, DPYD, ENTPD5 GSK3B 3047/4885CDK4 439/4885KDR 2543/4885

“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.