SCHEMBL19998191

SCHEMBL19998191

COc1c(Nc2c[nH]c(C)c2)nc(Sc2ccc(NC(C)=O)cc2)nc1N1CCC(O)C1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 1/20 0.54
AURKB Q96GD4 8/20 0.42
AURKA O14965 7/20 0.42
SRC P12931 2/20 0.40
GSK3B P49841 2/20 0.40
AURKC Q9UQB9 1/20 0.40
ABL1 P00519 7/20 0.39
PIK3CA P42336 3/20 0.38
MTOR P42345 2/20 0.38

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
SCHEMBL19990852 0.88 PLK4 (0.69) PLK4AURKBAURKASRCGSK3B
SCHEMBL18165810 0.85 PLK4 (0.73) PLK4AURKBAURKASRCGSK3B
SCHEMBL19990899 0.80 PLK4 (0.72) PLK4AURKBAURKASRCGSK3B
SCHEMBL18154811 0.79 PLK4 (0.73) PLK4AURKBAURKASRCGSK3B
SCHEMBL18154758 0.79 PLK4 (0.73) PLK4AURKBAURKASRCGSK3B
SCHEMBL18154739 0.79 PLK4 (0.73) PLK4AURKBAURKASRCGSK3B
SCHEMBL18154687 0.78 PLK4 (0.75) PLK4AURKBAURKASRCGSK3B
SCHEMBL18166073 0.78 PLK4 (0.86) PLK4AURKBAURKASRCGSK3B
SCHEMBL19990643 0.77 PLK4 (0.70) PLK4AURKBAURKASRCGSK3B
SCHEMBL18166037 0.77 PLK4 (0.62) PLK4AURKBAURKASRCGSK3B

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
US-10752612-B2 PLK4 inhibitors LUDWIG INSTITUTE FOR CANCER RESEARCH LTD (CH) 2020-08-25 US disclosed
US-20180086739-A1 PLK4 INHIBITORS LUDWIG INSTITUTE FOR CANCER RESEARCH LTD (CH) 2018-03-29 US disclosed
US-20180086739-A1 PLK4 INHIBITORS LUDWIG INSTITUTE FOR CANCER RESEARCH LTD (CH) 2018-03-29 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 (2 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-20180086739-A1 PLK4 INHIBITORS PLK4, PLK2, PLK3 PLK4 1/4885AURKB 23/4885AURKA 32/4885
US-10752612-B2 PLK4 inhibitors PLK4, PLK2, PLK3 PLK4 1/4885AURKB 23/4885AURKA 32/4885

“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.