SCHEMBL24324062

SCHEMBL24324062

CSc1nnc2n(CCc3ccncc3)c(=O)c3cccc(F)c3n12

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 5/20 0.52
TSHR P16473 1/20 0.42
TP53 P04637 2/20 0.40
GAA P10253 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
ALDH1A1 P00352 3/20 0.39
GPBAR1 Q8TDU6 1/20 0.39
ABCC1 P33527 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 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
SCHEMBL26851577 0.93 PLK1 (0.60) PLK1TSHRTP53CA12CA1
SCHEMBL29446334 0.86 PLK1 (0.59) PLK1TSHRGAAALDH1A1MAPT
SCHEMBL24324040 0.86 PLK1 (0.59) PLK1TSHRGAAALDH1A1MAPT
SCHEMBL24324063 0.85 PLK1 (0.45) PLK1TSHRGAASMN1; SMN2HSD17B10
SCHEMBL24324355 0.84 PLK1 (0.51) PLK1TSHRTP53GAAALDH1A1
SCHEMBL26851612 0.84 PLK1 (0.52) PLK1TSHRGAAALDH1A1MAPT
SCHEMBL24324353 0.83 PLK1 (0.46) PLK1TSHRGAAALDH1A1GPBAR1
SCHEMBL26851619 0.82 PLK1 (0.45) PLK1TSHRTP53GAAALDH1A1
SCHEMBL24324061 0.79 PLK1 (0.41) PLK1TSHRGAAALDH1A1GPBAR1
SCHEMBL29446367 0.79 PLK1 (0.56) PLK1TSHRGAAALDH1A1MAPT

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 1/4885TSHR 3771/4885TP53 92/4885

“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.