SCHEMBL16296803

SCHEMBL16296803

COc1ccc(C2=C(NC(C)=O)C(=O)c3ccccc3C2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 16/20 1.00
HSP90AB1 P08238 16/20 1.00
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
MAPT P10636 2/20 0.64

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
SCHEMBL16296654 0.88 HSP90AA1 (1.00) HSP90AA1HSP90AB1
SCHEMBL16296899 0.86 HSP90AA1 (1.00) HSP90AA1HSP90AB1MEN1KMT2AMAPT
SCHEMBL16296838 0.85 HSP90AA1 (1.00) HSP90AA1HSP90AB1MAPT
SCHEMBL19625612 0.84 HSP90AA1 (0.80) HSP90AA1HSP90AB1MEN1KMT2A
SCHEMBL16297031 0.84 HSP90AA1 (1.00) HSP90AA1HSP90AB1MEN1KMT2AMAPT
SCHEMBL16297078 0.83 HSP90AA1 (1.00) HSP90AA1HSP90AB1MAPT
SCHEMBL16296819 0.83 HSP90AA1 (0.93) HSP90AA1HSP90AB1MEN1KMT2AMAPT
SCHEMBL19625592 0.82 HSP90AA1 (0.91) HSP90AA1HSP90AB1MEN1KMT2AMAPT
SCHEMBL16296801 0.82 HSP90AA1 (1.00) HSP90AA1HSP90AB1MEN1KMT2AMAPT
SCHEMBL19409309 0.82 HSP90AA1 (0.69) HSP90AA1HSP90AB1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY UNIVERSITY OF KANSAS 2017-11-23 US disclosed
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY UNIVERSITY OF KANSAS 2017-11-23 US disclosed
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY UNIVERSITY OF KANSAS 2017-11-23 US disclosed
US-9745261-B2 Inhibitors of the MITF molecular pathway THE GENERAL HOSPITAL CORPORATION (US) 2017-08-29 US disclosed
US-9745261-B2 Inhibitors of the MITF molecular pathway THE GENERAL HOSPITAL CORPORATION (US) 2017-08-29 US disclosed
US-9745261-B2 Inhibitors of the MITF molecular pathway THE GENERAL HOSPITAL CORPORATION (US) 2017-08-29 US disclosed
US-20160130222-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY THE BROAD INSTITUTE, INC. 2016-05-12 US disclosed
US-20160130222-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY THE BROAD INSTITUTE, INC. 2016-05-12 US disclosed
US-20160130222-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY THE BROAD INSTITUTE, INC. 2016-05-12 US disclosed
EP-3007688-A2 INHIBITORS OF THE MITF MOLECULAR PATHWAY The General Hospital Corporation (US) 2016-04-20 EP disclosed
WO-2014201016-A2 INHIBITORS OF THE MITF MOLECULAR PATHWAY THE GENERAL HOSPITAL CORPORATION (US) 2014-12-18 WO disclosed
WO-2014201016-A2 INHIBITORS OF THE MITF MOLECULAR PATHWAY THE GENERAL HOSPITAL CORPORATION (US) 2014-12-18 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 (2 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-20160130222-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY MITF, TFEB, TYR HSP90AA1 2413/4885HSP90AB1 1684/4885MEN1 1616/4885
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY MITF, TFEB, TYR HSP90AA1 2375/4885HSP90AB1 1696/4885MEN1 1568/4885

“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.