SCHEMBL20206967

SCHEMBL20206967

O=C(Nc1ccccc1)c1cc(O)c(=O)c2c(O)c(O)c(F)cc2c1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.65
TOP1 P11387 3/20 0.50
TOP2A P11388 3/20 0.50
TOP2B Q02880 3/20 0.50
SNCA P37840 4/20 0.49
ABCC1 P33527 1/20 0.45
PLAU P00749 1/20 0.43

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
SCHEMBL20207016 0.87 PTPN11 (0.49) PTPN11TOP1TOP2ATOP2BSNCA
SCHEMBL1812080 0.78 TOP1 (0.81) TOP1TOP2ATOP2BSNCAABCC1
SCHEMBL20187640 0.76 PTPN11 (1.00) PTPN11SNCA
SCHEMBL20206977 0.73 PTPN11 (0.71) PTPN11
SCHEMBL28277339 0.72 TOP1 (0.77) TOP1TOP2ATOP2BSNCAABCC1
SCHEMBL11789948 0.71 TOP1 (0.54) TOP1TOP2ATOP2BPLAU
SCHEMBL29381898 0.69 ERN1 (0.50) TOP1TOP2ATOP2BSNCA
SCHEMBL22466044 0.69 ERN1 (0.50) TOP1TOP2ATOP2BSNCA
SCHEMBL2911616 0.69 HDAC2 (0.71) PLAU
SCHEMBL468884 0.69 PTPN11 (0.79) PTPN11SNCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3544952-B1 HALOGENATED BENZOTROPOLONES AS ATG4B INHIBITORS UNIV ANTWERPEN (BE) 2024-11-06 EP disclosed
US-10738002-B2 Halogenated benzotropolones as ATG4B inhibitors UNIVERSITAIR ZIEKENHUIS ANTWERPEN (BE) 2020-08-11 US disclosed
US-10738002-B2 Halogenated benzotropolones as ATG4B inhibitors UNIVERSITAIR ZIEKENHUIS ANTWERPEN (BE) 2020-08-11 US disclosed
US-20190284130-A1 HALOGENATED BENZOTROPOLONES AS ATG4B INHIBITORS UNIVERSITEIT ANTWERPEN (BE) 2019-09-19 US disclosed
US-20190284130-A1 HALOGENATED BENZOTROPOLONES AS ATG4B INHIBITORS UNIVERSITEIT ANTWERPEN (BE) 2019-09-19 US disclosed
WO-2018096088-A1 HALOGENATED BENZOTROPOLONES AS ATG4B INHIBITORS UNIVERSITEIT ANTWERPEN (BE) 2018-05-31 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 (2 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-20190284130-A1 HALOGENATED BENZOTROPOLONES AS ATG4B INHIBITORS ATG4B, ATG7, ATG4A PTPN11 2700/4885TOP1 2951/4885TOP2A 2831/4885
US-10738002-B2 Halogenated benzotropolones as ATG4B inhibitors ATG4B, ATG7, BECN1 PTPN11 2737/4885TOP1 2859/4885TOP2A 2481/4885

“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.