SCHEMBL13723527

SCHEMBL13723527

Cc1[nH]c2ccccc2c1C=CC(=O)c1ccncc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 1.00
▸ MEN1 O00255 7/20 1.00
▸ KMT2A Q03164 7/20 1.00
▸ PSMD14 O00487 1/20 1.00
▸ L3MBTL1 Q9Y468 1/20 1.00
▸ LMNA P02545 6/20 0.80
▸ ALDH1A1 P00352 5/20 0.80
▸ PIKFYVE Q9Y2I7 1/20 0.67
▸ CYP1A2 P05177 5/20 0.51
▸ CYP2D6 P10635 5/20 0.51
▸ SMN1; SMN2 Q16637 5/20 0.51
▸ HPGD P15428 4/20 0.51
▸ MAPK1 P28482 3/20 0.51
▸ CYP1A1 P04798 2/20 0.51
▸ CYP1B1 Q16678 2/20 0.51
▸ NPY1R P25929 1/20 0.51
▸ NPY2R P49146 1/20 0.51
▸ NPC1 O15118 7/20 0.50
▸ RAB9A P51151 7/20 0.50
▸ HTT P42858 3/20 0.50

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
SCHEMBL13723525 1.00 MAPT (1.00) MAPTMEN1KMT2APSMD14L3MBTL1
SCHEMBL13724027 0.84 MEN1 (0.71) MAPTMEN1KMT2APSMD14L3MBTL1
SCHEMBL13724457 0.84 MEN1 (0.71) MAPTMEN1KMT2APSMD14L3MBTL1
SCHEMBL13724455 0.84 MEN1 (0.71) MAPTMEN1KMT2APSMD14L3MBTL1
SCHEMBL13724025 0.84 MEN1 (0.71) MAPTMEN1KMT2APSMD14L3MBTL1
SCHEMBL21215893 0.84 PIKFYVE (0.73) MAPTMEN1KMT2APSMD14L3MBTL1
SCHEMBL16756021 0.83 PIKFYVE (0.72) MAPTMEN1KMT2APSMD14L3MBTL1
SCHEMBL16756020 0.83 PIKFYVE (0.72) MAPTMEN1KMT2APSMD14L3MBTL1
SCHEMBL13727053 0.82 KMT2A (0.76) MAPTMEN1KMT2APSMD14L3MBTL1
SCHEMBL13824754 0.82 KMT2A (0.76) MAPTMEN1KMT2APSMD14L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9028796-B2 Materials and methods useful to induce cell death via methuosis THE UNIVERSITY OF TOLEDO (US) 2015-05-12 — — US claimed
US-20140322128-A1 Materials and Methods Useful to Induce Cell Death via Methuosis THE UNIVERSITY OF TOLEDO (US) 2014-10-30 — — US claimed
WO-2012145069-A2 MATERIALS AND METHODS USEFUL TO INDUCE CELL DEATH VIA METHUOSIS THE UNIVERSITY OF TOLEDO (US) 2012-10-26 — — WO claimed
CN-116789642-A Tri-aromatic heterocyclic piperazine compound for inducing tumor cell to generate meta death and application thereof 华东师范大学 2023-09-22 — — CN disclosed
US-20190015379-A1 USE OF DIANHYDROGALACTITOL AND ANALOGS AND DERIVATIVES THEREOF, TOGETHER WITH RADIATION, TO TREAT NON-SMALL-CELL CARCINOMA OF THE LUNG AND GLIOBLASTOMA MULTIFORME AND SUPPRESS PROLIFERATION OF CANCER STEM CELLS DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2019-01-17 — — US disclosed
EP-3217970-A1 DIANHYDROGALACTITOL TOGETHER WITH RADIATION TO TREAT NON-SMALL-CELL CARCINOMA OF THE LUNG AND GLIOBLASTOMA MULTIFORME Del Mar Pharmaceuticals (CA) 2017-09-20 — — EP disclosed
WO-2016077264-A1 DIANHYDROGALACTITOL TOGETHER WITH RADIATION TO TREAT NON-SMALL-CELL CARCINOMA OF THE LUNG AND GLIOBLASTOMA MULTIFORME DEL MAR PHARMACEUTICALS (CA) 2016-05-19 — — WO disclosed
US-9061994-B1 Materials and methods useful to induce vacuolization, cell death, or a combination thereof THE UNIVERSITY OF TOLEDO (US) 2015-06-23 — — US disclosed
US-20150152049-A1 Materials And Methods Useful To Induce Vacuolization, Cell Death, Or A Combination Thereof THE UNIVERSITY OF TOLEDO (US) 2015-06-04 — — US disclosed
US-9028796-B2 Materials and methods useful to induce cell death via methuosis THE UNIVERSITY OF TOLEDO (US) 2015-05-12 — — US disclosed
US-9023871-B2 Materials and Methods Useful to Induce Vacuolization, Cell Death, or a Combination Thereof THE UNIVERSITY OF TOLEDO (US) 2015-05-05 — — US disclosed
US-20140322128-A1 Materials and Methods Useful to Induce Cell Death via Methuosis THE UNIVERSITY OF TOLEDO (US) 2014-10-30 — — US disclosed
US-20140213615-A1 Materials and Methods Useful to Induce Vacuolization, Cell Death, or a Combination Thereof THE UNIVERSITY OF TOLEDO (US) 2014-07-31 — — US disclosed
WO-2012145069-A2 MATERIALS AND METHODS USEFUL TO INDUCE CELL DEATH VIA METHUOSIS THE UNIVERSITY OF TOLEDO (US) 2012-10-26 — — 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 (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-20150152049-A1 Materials And Methods Useful To Induce Vacuolization, Cell Death, Or A Combination Thereof BECN1, BAD, BAX MAPT 2529/4885MEN1 1465/4885KMT2A 3031/4885
US-20140213615-A1 Materials and Methods Useful to Induce Vacuolization, Cell Death, or a Combination Thereof BECN1, BAD, BAX MAPT 2529/4885MEN1 1465/4885KMT2A 3031/4885
US-20190015379-A1 USE OF DIANHYDROGALACTITOL AND ANALOGS AND DERIVATIVES THEREOF, TOGETHER WITH RADIATION, TO TREAT NON-SMALL-CELL CARCINOMA OF THE LUNG AND GLIOBLASTOMA MULTIFORME AND SUPPRESS PROLIFERATION OF CANCER STEM CELLS MGMT, DCLRE1A, DNMT1 MAPT 4340/4885MEN1 1198/4885KMT2A 1245/4885
US-20140322128-A1 Materials and Methods Useful to Induce Cell Death via Methuosis MCL1, BAX, BCL2 MAPT 3329/4885MEN1 2167/4885KMT2A 2128/4885

“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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