SCHEMBL14507765

SCHEMBL14507765

Cn1cc(-c2cnc3c(Nc4cc(C5CCNCC5)cs4)nccn23)cn1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 8/20 0.73
▸ AURKB Q96GD4 7/20 0.73
▸ CHEK1 O14757 1/20 0.41
▸ FLT3 P36888 2/20 0.38
▸ PTK6 Q13882 3/20 0.37
▸ DYRK1A Q13627 2/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ TTK P33981 4/20 0.35
▸ CLK1 P49759 1/20 0.35
▸ CLK2 P49760 1/20 0.35
▸ HIPK1 Q86Z02 1/20 0.35
▸ HIPK2 Q9H2X6 1/20 0.35
▸ HIPK3 Q9H422 1/20 0.35
▸ CLK4 Q9HAZ1 1/20 0.35

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
SCHEMBL8241796 0.85 AURKB (1.00) AURKAAURKBCHEK1FLT3PTK6
SCHEMBL8246514 0.83 AURKA (0.67) AURKAAURKBFLT3PTK6TTK
SCHEMBL8240971 0.82 AURKA (0.66) AURKAAURKBFLT3PTK6DYRK1A
SCHEMBL8240332 0.82 AURKA (1.00) AURKAAURKBCHEK1FLT3PTK6
SCHEMBL8241241 0.81 AURKA (0.90) AURKAAURKBCHEK1FLT3
SCHEMBL12404449 0.79 AURKB (0.64) AURKAAURKBCHEK1PTK6DYRK1A
SCHEMBL8241005 0.78 AURKA (0.64) AURKAAURKBCHEK1FLT3TTK
SCHEMBL8240362 0.78 AURKB (0.88) AURKAAURKBCHEK1TTK
SCHEMBL8241235 0.77 AURKA (0.81) AURKAAURKBCHEK1
SCHEMBL12404542 0.76 AURKA (0.62) AURKAAURKBCHEK1PTK6TTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007056468-A1 METHODS FOR INHIBITING PROTEIN KINASES SCHERING CORPORATION (US) 2007-05-18 — — WO disclosed
US-20070105864-A1 Methods for inhibiting protein kinases SCHERING CORPORATION 2007-05-10 — — US disclosed
US-20070105864-A1 Methods for inhibiting protein kinases SCHERING CORPORATION 2007-05-10 — — 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-20070105864-A1 Methods for inhibiting protein kinases PIM1, PIM2, PIM3 AURKA 5/4885AURKB 24/4885CHEK1 27/4885

“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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