SCHEMBL20547699

SCHEMBL20547699

NS(=O)(=O)c1ccc(C(=O)CCC(=O)c2ccc(Br)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 16/20 0.64
CA1 P00915 13/20 0.59
CA9 Q16790 12/20 0.59
CA12 O43570 7/20 0.59
CA7 P43166 3/20 0.59
CA14 Q9ULX7 2/20 0.59
KMT2A Q03164 1/20 0.56
HSD11B1 P28845 1/20 0.55
CA3 P07451 1/20 0.53
CA6 P23280 1/20 0.53
CYP2C19 P33261 1/20 0.53
CA5A P35218 1/20 0.53
CA5B Q9Y2D0 1/20 0.53
CA4 P22748 3/20 0.52
NPC1 O15118 1/20 0.52
ALDH1A1 P00352 1/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
GSK3B P49841 1/20 0.50

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
SCHEMBL241664 0.82 GSK3B (0.70) CA2CA1KMT2AHSD11B1ALDH1A1
SCHEMBL11628318 0.82 GSR (0.63) KMT2AHSD11B1GSK3B
SCHEMBL30239791 0.81 CA2 (0.45) CA2CA1CA9CA12CA7
SCHEMBL183959 0.80 CA2 (1.00) CA2CA1CA9CA12CA7
SCHEMBL3642480 0.79 CA2 (0.59) CA2CA1CA9CA12CA7
Hydrochloric Acid SCHEMBL3536600 0.78 CA2 (0.95) CA2CA1CA9CA12CA7
SCHEMBL13918103 0.78 CA2 (0.62) CA2CA1CA9CA12CA7
SCHEMBL29670519 0.77 GSK3B (0.57) KMT2AHSD11B1ALDH1A1SMN1; SMN2GSK3B
SCHEMBL10830565 0.76 CA2 (0.59) CA2CA1CA9CA12CA7
SCHEMBL7857047 0.76 CA2 (0.61) CA2CA1CA9CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3615525-B1 PYRROLE DERIVATIVES AS PLK1 INHIBITORS SENTINEL ONCOLOGY LTD (GB) 2024-12-25 EP disclosed
US-11884656-B2 Pyrrole derivatives as PLK1 inhibitors SENTINEL ONCOLOGY LIMITED (GB) 2024-01-30 US disclosed
US-20220135552-A1 PYRROLE DERIVATIVES AS PLK1 INHIBITORS SENTINEL ONCOLOGY LIMITED (GB) 2022-05-05 US disclosed
US-11208405-B2 Pyrrole derivatives as PLK1 inhibitors SENTINEL ONCOLOGY LIMITED (GB) 2021-12-28 US disclosed
US-20200247796-A1 PYRROLE DERIVATIVES AS PLK1 INHIBITORS SENTINEL ONCOLOGY LIMITED (GB) 2020-08-06 US disclosed
EP-3615525-A1 PYRROLE DERIVATIVES AS PLK1 INHIBITORS Sentinel Oncology Limited (GB) 2020-03-04 EP disclosed
WO-2018197714-A1 PYRROLE DERIVATIVES AS PLK1 INHIBITORS SENTINEL ONCOLOGY LIMITED (GB) 2018-11-01 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 (4 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-11884656-B2 Pyrrole derivatives as PLK1 inhibitors PLK1, CDK1, AURKC CA2 1493/4885CA1 2065/4885CA9 2796/4885
US-20200247796-A1 PYRROLE DERIVATIVES AS PLK1 INHIBITORS PLK1, CDK1, AURKC CA2 1567/4885CA1 2098/4885CA9 2836/4885
US-20220135552-A1 PYRROLE DERIVATIVES AS PLK1 INHIBITORS PLK1, CDK1, AURKC CA2 1493/4885CA1 2065/4885CA9 2796/4885
US-11208405-B2 Pyrrole derivatives as PLK1 inhibitors PLK1, CDK1, AURKC CA2 1567/4885CA1 2098/4885CA9 2836/4885

“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.