SCHEMBL13764010

SCHEMBL13764010

NC(=O)c1cccc(-n2nnc3cnc(Nc4ccc(C(=O)O)cc4)nc32)c1

nearest known ligand 0.79

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 13/20 0.79
▸ GSK3A P49840 12/20 0.79
▸ AURKA O14965 8/20 0.79
▸ EGFR P00533 1/20 0.48
▸ FLT3 P36888 1/20 0.48
▸ BLK P51451 1/20 0.48
▸ EIF2AK4 Q9P2K8 1/20 0.45
▸ MAPK8 P45983 1/20 0.44
▸ MAPK10 P53779 1/20 0.44
▸ JAK2 O60674 1/20 0.43
▸ AURKB Q96GD4 1/20 0.43
▸ PTK2 Q05397 1/20 0.43

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
SCHEMBL13763823 0.90 GSK3A (0.62) GSK3BGSK3AAURKAEGFRFLT3
SCHEMBL13763922 0.88 GSK3B (1.00) GSK3BGSK3AAURKA
SCHEMBL13763924 0.88 GSK3B (0.79) GSK3BGSK3AAURKAEIF2AK4
SCHEMBL3424044 0.88 GSK3B (0.79) GSK3BGSK3AAURKAEGFREIF2AK4
SCHEMBL8297919 0.88 GSK3A (0.69) GSK3BGSK3AAURKAEGFRFLT3
SCHEMBL13764067 0.87 AURKA (0.65) GSK3BGSK3AAURKAEGFRFLT3
SCHEMBL13764025 0.86 GSK3B (0.76) GSK3BGSK3AAURKAEGFRFLT3
SCHEMBL13764026 0.86 GSK3B (0.69) GSK3BGSK3AAURKAMAPK8MAPK10
SCHEMBL13949717 0.86 GSK3A (0.63) GSK3BGSK3AAURKAEGFRFLT3
SCHEMBL13764033 0.85 GSK3B (0.73) GSK3BGSK3AAURKAEIF2AK4PTK2

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
US-7560458-B2 Triazolopyrimidine derivatives as glycogen synthase kinase 3 inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2009-07-14 — — US disclosed
US-7560458-B2 Triazolopyrimidine derivatives as glycogen synthase kinase 3 inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2009-07-14 — — US disclosed
US-20090036471-A1 Triazolopyrimidine Derivatives As Glycogen Synthase Kinase 3 Inhibitors EDGARD EDDY JEAN 2009-02-05 — — US disclosed
US-20090036471-A1 Triazolopyrimidine Derivatives As Glycogen Synthase Kinase 3 Inhibitors EDGARD EDDY JEAN 2009-02-05 — — 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-20090036471-A1 Triazolopyrimidine Derivatives As Glycogen Synthase Kinase 3 Inhibitors GSK3B, GSK3A, GYS2 GSK3B 1/4885GSK3A 2/4885AURKA 173/4885

“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.

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