SCHEMBL22767705

SCHEMBL22767705

Cc1cc(Nc2nc(Sc3ccccc3)nc(N(C)C)c2C)n[nH]1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AURKA O14965 18/20 0.67
GSK3B P49841 16/20 0.67
AURKB Q96GD4 13/20 0.67
SRC P12931 9/20 0.67
AURKC Q9UQB9 1/20 0.52
NTRK1 P04629 1/20 0.51

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
SCHEMBL18166026 0.89 AURKA (0.62) AURKAGSK3BAURKBSRCAURKC
SCHEMBL29487420 0.89 AURKA (0.62) AURKAGSK3BAURKBSRCAURKC
SCHEMBL18154839 0.84 AURKB (0.68) AURKAGSK3BAURKBSRCAURKC
SCHEMBL29487425 0.81 AURKA (0.51) AURKAGSK3BAURKBSRCAURKC
SCHEMBL19998181 0.81 AURKA (0.51) AURKAGSK3BAURKBSRCAURKC
SCHEMBL12430446 0.80 AURKA (1.00) AURKAGSK3BAURKBSRCAURKC
SCHEMBL18154841 0.80 AURKB (0.70) AURKAGSK3BAURKBSRCAURKC
SCHEMBL18166041 0.80 AURKA (0.50) AURKAGSK3BAURKBSRCAURKC
SCHEMBL29487455 0.80 AURKA (0.50) AURKAGSK3BAURKBSRCAURKC
SCHEMBL19990856 0.79 AURKB (0.66) AURKAGSK3BAURKBSRCAURKC

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-20200383990-A1 METHODS OF TREATING CANCER WITH PLK4 INHIBITORS LUDWI INSTITUTE FOR CANCER RESEARCH LTD. (CH) 2020-12-10 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-20200383990-A1 METHODS OF TREATING CANCER WITH PLK4 INHIBITORS PLK4, PLK2, PLK3 AURKA 71/4885GSK3B 154/4885AURKB 28/4885

“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.