SCHEMBL24324038

SCHEMBL24324038

Cc1nnc2n(CCc3ccccc3)c(=O)c3cc(F)ccc3n12

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 8/20 0.66
TP53 P04637 3/20 0.57
ALDH1A1 P00352 5/20 0.55
MAPT P10636 2/20 0.54
KDM4E B2RXH2 1/20 0.53
HTT P42858 1/20 0.53
HSP90AA1 P07900 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52

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
SCHEMBL29446327 1.00 PLK1 (0.66) PLK1TP53ALDH1A1MAPTKDM4E
SCHEMBL24324052 0.88 PLK1 (0.64) PLK1TP53ALDH1A1MAPTKDM4E
SCHEMBL29446347 0.80 PLK1 (0.60) PLK1
SCHEMBL24324217 0.80 PLK1 (0.60) PLK1
SCHEMBL24324738 0.79 PLK1 (1.00) PLK1
SCHEMBL29446338 0.79 PLK1 (1.00) PLK1
SCHEMBL24247595 0.74 HDAC1 (0.71) PLK1MAPT
SCHEMBL29446464 0.73 PLK1 (1.00) PLK1
SCHEMBL24324229 0.73 PLK1 (1.00) PLK1
SCHEMBL26851996 0.73 TP53 (0.60) PLK1TP53ALDH1A1MAPTHSP90AA1

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-20230365568-A1 PLK1 POLO BOX DOMAIN INHIBITORS AND METHOD OF TREATING CANCER THE UNITED STATES OF AMERICA,AS REPRESENTED BY THE SECRETARY,DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-11-16 US disclosed
US-20230365568-A1 PLK1 POLO BOX DOMAIN INHIBITORS AND METHOD OF TREATING CANCER THE UNITED STATES OF AMERICA,AS REPRESENTED BY THE SECRETARY,DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-11-16 US disclosed
WO-2022067100-A2 PLK1 POLO BOX DOMAIN INHIBITOR AND METHOD OF TREATING CANCER THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2022-03-31 WO 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-20230365568-A1 PLK1 POLO BOX DOMAIN INHIBITORS AND METHOD OF TREATING CANCER PLK1, PLK4, BUB1B PLK1 1/4885TP53 92/4885ALDH1A1 4253/4885

“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.