SCHEMBL20547658

SCHEMBL20547658

N#Cc1ccc(C=C(Br)Br)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 4/20 0.59
▸ CA2 P00918 2/20 0.46
▸ CA12 O43570 1/20 0.46
▸ CA3 P07451 1/20 0.46
▸ CA6 P23280 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ CA14 Q9ULX7 1/20 0.46
▸ ALDH1A1 P00352 6/20 0.46
▸ KDM4E B2RXH2 4/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ PKM P14618 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ LMNA P02545 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ GAA P10253 1/20 0.42
▸ MMP3 P08254 1/20 0.41

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
SCHEMBL18023350 0.83 FBP1 (0.56) FBP1CA2CA12CA3CA6
SCHEMBL13267511 0.83 FBP1 (0.56) FBP1CA2CA12CA3CA6
SCHEMBL566441 0.79 FBP1 (0.57) FBP1CA2CA12CA3CA6
SCHEMBL566440 0.79 FBP1 (0.57) FBP1CA2CA12CA3CA6
SCHEMBL6824611 0.77 KMT2A (0.77) FBP1CA2CA12CA3CA6
SCHEMBL26604322 0.77 FBP1 (0.50) FBP1CA2CA12CA3CA6
SCHEMBL14198043 0.77 FBP1 (0.59) FBP1CA2CA12CA3CA6
SCHEMBL28465290 0.77 ALDH1A1 (0.58) FBP1CA2CA12CA3CA6
SCHEMBL3246531 0.75 AKR1C3 (0.62) FBP1ALDH1A1KDM4EKMT2APKM
SCHEMBL2439472 0.75 FBP1 (0.57) FBP1CA2ALDH1A1KDM4EKMT2A

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 12 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
CN-118702593-A Preparation method and application of bisacylhydrazone derivative 沈阳药科大学 2024-09-27 — — CN disclosed
US-11884656-B2 Pyrrole derivatives as PLK1 inhibitors SENTINEL ONCOLOGY LIMITED (GB) 2024-01-30 — — US disclosed
EP-4276087-A1 BETA-ELEMENE VINYLATION COUPLED DERIVATIVE, AND PREPARATION THEREOF AND USE THEREOF IN PREPARATION OF ANTITUMOR DRUG Hangzhou Normal University (CN) 2023-11-15 — — EP disclosed
WO-2023160035-A1 β-ELEMENE VINYLATION COUPLED DERIVATIVE, AND PREPARATION THEREOF AND USE THEREOF IN PREPARATION OF ANTITUMOR DRUG 杭州师范大学 2023-08-31 — — WO disclosed
CN-110573503-B Pyrrole derivatives as PLK1 inhibitors 圣提内尔肿瘤学有限公司 2023-03-17 — — CN 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
CN-110573503-A pyrrole derivatives as PLK1 inhibitors 圣提内尔肿瘤学有限公司 2019-12-13 — — CN 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 FBP1 2320/4885CA2 1493/4885CA12 3652/4885
US-20200247796-A1 PYRROLE DERIVATIVES AS PLK1 INHIBITORS PLK1, CDK1, AURKC FBP1 2413/4885CA2 1567/4885CA12 3736/4885
US-20220135552-A1 PYRROLE DERIVATIVES AS PLK1 INHIBITORS PLK1, CDK1, AURKC FBP1 2320/4885CA2 1493/4885CA12 3652/4885
US-11208405-B2 Pyrrole derivatives as PLK1 inhibitors PLK1, CDK1, AURKC FBP1 2413/4885CA2 1567/4885CA12 3736/4885

“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.

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