SCHEMBL801548

SCHEMBL801548

COc1ccc(C(=O)c2coc3c2CC(=O)c2ccccc2-3)cc1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDF Q9HBH1 2/20 0.53
NPSR1 Q6W5P4 4/20 0.47
MAPT P10636 4/20 0.47
KDM4E B2RXH2 3/20 0.47
MAPK1 P28482 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
RAB9A P51151 1/20 0.47
HKDC1 Q2TB90 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
CYP2C19 P33261 1/20 0.46
GAA P10253 3/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HTT P42858 2/20 0.45
NPC1 O15118 1/20 0.45
ACHE P22303 4/20 0.44
BCHE P06276 3/20 0.44

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
SCHEMBL298938 0.81 MAPT (0.72) PDFNPSR1MAPTKDM4EMAPK1
SCHEMBL6001071 0.69 STAT3 (0.59) PDFNPSR1MAPTKDM4EMAPK1
SCHEMBL11576360 0.69 CYP1A2 (0.70) NPSR1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL18288117 0.69 CYP1A2 (0.60) MAPTKDM4ECYP1A2CYP3A4CYP2C9
SCHEMBL290717 0.69 PDF (1.00) PDFNPSR1MAPTKDM4EMAPK1
SCHEMBL289533 0.69 PDF (1.00) PDFNPSR1MAPTKDM4EMAPK1
SCHEMBL299173 0.69 PDF (0.69) PDFNPSR1MAPTKDM4EMAPK1
SCHEMBL16994921 0.68 PDF (0.67) PDFNPSR1MAPTKDM4EMAPK1
SCHEMBL801804 0.68 PDF (0.72) PDFNPSR1MAPTKDM4EMAPK1
SCHEMBL801241 0.67 PDF (0.73) PDFNPSR1MAPTKDM4EMAPK1

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 2 patents. 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
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 1/4885NPSR1 2690/4885MAPT 3128/4885

“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.