SCHEMBL801214

SCHEMBL801214

O=C1C(=O)c2c(C(=O)c3ccccc3)coc2-c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 1.00
▸ ALDH1A1 P00352 8/20 1.00
▸ MEN1 O00255 7/20 1.00
▸ KMT2A Q03164 7/20 1.00
▸ LMNA P02545 7/20 1.00
▸ HTT P42858 6/20 1.00
▸ HKDC1 Q2TB90 6/20 1.00
▸ KDM4E B2RXH2 4/20 1.00
▸ HPGD P15428 4/20 1.00
▸ CDC25A P30304 1/20 1.00
▸ CDC25B P30305 1/20 1.00
▸ CDC25C P30307 1/20 1.00
▸ MPI P34949 1/20 1.00
▸ NPSR1 Q6W5P4 7/20 0.83
▸ TDP1 Q9NUW8 4/20 0.83
▸ CASP3 P42574 3/20 0.83
▸ SENP8 Q96LD8 3/20 0.83
▸ SENP7 Q9BQF6 3/20 0.83
▸ SENP6 Q9GZR1 3/20 0.83
▸ APAF1 O14727 3/20 0.83

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
SCHEMBL299444 0.85 MAPT (1.00) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL801218 0.84 MAPT (0.72) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL13076407 0.83 MAPT (0.71) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL801236 0.82 MAPT (0.69) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL290290 0.82 PDF (1.00) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL290276 0.82 PDF (0.70) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL13076408 0.81 MAPT (0.68) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL298938 0.79 MAPT (0.72) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL299173 0.79 PDF (0.69) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL805350 0.79 MAPT (0.64) MAPTALDH1A1MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9909160-B2 Modulators of alpha-synuclein toxicity WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2018-03-06 — — US disclosed
US-9879257-B2 Modulators of alpha-synuclein toxicity WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2018-01-30 — — US disclosed
US-20160215321-A1 MODULATORS OF ALPHA-SYNUCLEIN TOXICITY WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH 2016-07-28 — — US disclosed
US-20160046933-A1 MODULATORS OF ALPHA-SYNUCLEIN TOXICITY WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH 2016-02-18 — — US disclosed
US-9249444-B2 Modulators of alpha-synuclein toxicity WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-02-02 — — US disclosed
EP-2959898-A1 4,5-DIOXO-NAPHTHO[1,2-b]FURANS AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS Sloan-Kettering Institute for Cancer Research (US) 2015-12-30 — — EP disclosed
US-9018003-B2 Modulators of alpha-synuclein toxicity WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2015-04-28 — — US disclosed
US-20140051091-A1 MODULATORS OF ALPHA-SYNUCLEIN TOXICITY WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2014-02-20 — — US disclosed
US-8501465-B2 Modulators of alpha-synuclein toxicity WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2013-08-06 — — 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
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-20110064722-A1 MODULATORS OF ALPHA-SYNUCLEIN TOXICITY Whitehead Institute for Miomedical Reasearch (US) 2011-03-17 — — US disclosed
WO-2010129049-A1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2010-11-11 — — WO disclosed
US-20090304664-A1 MODULATORS OF ALPHA-SYNUCLEIN TOXICITY WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2009-12-10 — — US disclosed
EP-1888095-A4 MODULATORS OF ALPHA-SYNUCLEIN TOXICITY WHITEHEAD BIOMEDICAL INST (US) 2009-08-26 — — EP disclosed
WO-2009086306-A1 MODULATORS OF ALPHA-SYNUCLEIN TOXICITY WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2009-07-09 — — WO disclosed
EP-1888095-A2 MODULATORS OF ALPHA-SYNUCLEIN TOXICITY WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2008-02-20 — — EP disclosed
WO-2006124892-A2 MODULATORS OF ALPHA-SYNUCLEIN TOXICITY WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2006-11-23 — — 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 (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 MAPT 3128/4885ALDH1A1 3464/4885MEN1 2230/4885

“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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