SCHEMBL13723964

SCHEMBL13723964

Cc1[nH]c2ccc(C(=O)c3ccccc3)cc2c1C=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
ALDH1A1 P00352 4/20 0.49
LMNA P02545 2/20 0.49
KDM4E B2RXH2 3/20 0.49
HPGD P15428 2/20 0.49
THRB P10828 1/20 0.49
RAB9A P51151 4/20 0.47
POLB P06746 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TDP1 Q9NUW8 2/20 0.43
NPC1 O15118 2/20 0.43
GAA P10253 1/20 0.43
TP53 P04637 2/20 0.42
CHEK1 O14757 1/20 0.42
KDR P35968 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HCRTR1 O43613 2/20 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
SCHEMBL13723640 0.89 ALDH1A1 (0.50) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL13726361 0.83 ALDH1A1 (0.55) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL11686180 0.82 PPARG (0.47) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL13724457 0.79 MEN1 (0.71) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL13724455 0.79 MEN1 (0.71) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL11063183 0.77 KIF11 (0.62) MAPTMEN1KMT2AALDH1A1KDM4E
Acetic Acid SCHEMBL28679441 0.76 MAPT (0.60) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL11069044 0.74 ALDH1A1 (0.57) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL29951087 0.74 GAA (0.54) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL10941882 0.74 MEN1 (0.55) MAPTMEN1KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012145069-A2 MATERIALS AND METHODS USEFUL TO INDUCE CELL DEATH VIA METHUOSIS THE UNIVERSITY OF TOLEDO (US) 2012-10-26 WO claimed
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 (3 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-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.