SCHEMBL805358

SCHEMBL805358

CBC1=CC(=O)C(=O)c2c(C(=O)c3ccc(OC)cc3)coc21

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDF Q9HBH1 10/20 0.71
MAPT P10636 5/20 0.61
KDM4E B2RXH2 3/20 0.61
NPSR1 Q6W5P4 3/20 0.61
RAB9A P51151 3/20 0.61
MAPK1 P28482 2/20 0.61
HKDC1 Q2TB90 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
NPC1 O15118 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
KMT2A Q03164 5/20 0.44
MEN1 O00255 3/20 0.44
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.44
NR4A1 P22736 1/20 0.44
USP2 O75604 1/20 0.44
HSP90AA1 P07900 1/20 0.44
HTT P42858 2/20 0.41
APAF1 O14727 1/20 0.41
CASP3 P42574 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
SCHEMBL290315 0.83 PDF (1.00) PDFMAPTKDM4ENPSR1RAB9A
SCHEMBL289618 0.83 PDF (1.00) PDFMAPTKDM4ENPSR1RAB9A
SCHEMBL299444 0.76 MAPT (1.00) PDFMAPTKDM4ENPSR1RAB9A
SCHEMBL290072 0.76 PDF (1.00) PDFMAPTKDM4ENPSR1RAB9A
SCHEMBL290142 0.76 PDF (1.00) PDFMAPTKDM4ENPSR1RAB9A
SCHEMBL783241 0.74 PDF (1.00) PDFMAPTKDM4ENPSR1RAB9A
SCHEMBL290235 0.71 PDF (1.00) PDFMAPTKDM4ENPSR1RAB9A
SCHEMBL13077081 0.71 PDF (0.77) PDFMAPTKDM4ENPSR1RAB9A
SCHEMBL16994969 0.71 MAPT (0.80) PDFMAPTKDM4ENPSR1RAB9A
SCHEMBL289841 0.70 PDF (1.00) PDFMAPTKDM4ENPSR1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120071523-A1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2012-03-22 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 (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-20120071523-A1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS PDF, EIF5B, EIF4E PDF 1/4885MAPT 3128/4885KDM4E 169/4885

“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.