SCHEMBL17835134

SCHEMBL17835134

CCCC/C(=C\C1=C(C)C(=O)c2ccccc2C1=O)C(=O)NOC

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 13/20 0.67
CDC25B P30305 4/20 0.40
CDC25A P30304 3/20 0.40
PKM P14618 1/20 0.37
MAP2K7 O14733 2/20 0.35
S100A4 P26447 2/20 0.34
TDP2 O95551 1/20 0.34
PAX8 Q06710 1/20 0.34
HKDC1 Q2TB90 1/20 0.34
TLR9 Q9NR96 1/20 0.34
CAPN1 P07384 1/20 0.34

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
SCHEMBL14135227 1.00 APEX1 (0.67) APEX1CDC25BCDC25APKMMAP2K7
SCHEMBL15705620 0.89 APEX1 (0.59) APEX1CDC25BCDC25AMAP2K7TDP2
SCHEMBL15711188 0.88 APEX1 (0.53) APEX1CDC25BCDC25APKMMAP2K7
SCHEMBL17834000 0.87 APEX1 (0.54) APEX1TDP2PAX8HKDC1TLR9
SCHEMBL14135167 0.87 APEX1 (0.52) APEX1CDC25BCDC25APKMMAP2K7
SCHEMBL19500018 0.87 APEX1 (0.52) APEX1CDC25BCDC25APKMMAP2K7
SCHEMBL15711189 0.86 APEX1 (0.64) APEX1CDC25BCDC25AMAP2K7
SCHEMBL17835128 0.85 APEX1 (0.60) APEX1CDC25BCDC25AMAP2K7
SCHEMBL15705622 0.85 APEX1 (0.60) APEX1CDC25BCDC25AMAP2K7
SCHEMBL17689686 0.85 APEX1 (0.90) APEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11160770-B2 Compounds, compositions and methods for treating oxidative DNA damage disorders INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2021-11-02 US disclosed
US-20200215001-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING OXIDATIVE DNA DAMAGE DISORDERS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2020-07-09 US disclosed
US-20170304222-A1 Compounds, Compositions and Methods for Treating Oxidative DNA Damage Disorders INDIANA UNIV AND RES TECH CORP (US) 2017-10-26 US disclosed
US-20170304222-A1 Compounds, Compositions and Methods for Treating Oxidative DNA Damage Disorders INDIANA UNIV AND RES TECH CORP (US) 2017-10-26 US disclosed
US-20160166521-A1 Compounds, Compositions and Methods for Treating Oxidative DNA Damage Disorders INDIANA UNIVERSITY AND RES TECHNOLOGY CORP (US) 2016-06-16 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 (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-20200215001-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING OXIDATIVE DNA DAMAGE DISORDERS OGG1, UNG, ERCC4 APEX1 12/4885CDC25B 1413/4885CDC25A 1563/4885
US-20170304222-A1 Compounds, Compositions and Methods for Treating Oxidative DNA Damage Disorders OGG1, UNG, ERCC4 APEX1 12/4885CDC25B 1413/4885CDC25A 1563/4885
US-20160166521-A1 Compounds, Compositions and Methods for Treating Oxidative DNA Damage Disorders OGG1, UNG, ERCC4 APEX1 12/4885CDC25B 1281/4885CDC25A 1450/4885
US-11160770-B2 Compounds, compositions and methods for treating oxidative DNA damage disorders OGG1, UNG, ERCC4 APEX1 12/4885CDC25B 1413/4885CDC25A 1563/4885

“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.