SCHEMBL1815994

SCHEMBL1815994

O=C1C(Cl)=C(NS(=O)(=O)c2ccccc2)C(=O)c2ccccc21

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.71
KMT2A Q03164 4/20 0.71
HTT P42858 3/20 0.71
MAPK1 P28482 2/20 0.71
NPSR1 Q6W5P4 2/20 0.71
NAT1 P18440 12/20 0.68
LMNA P02545 4/20 0.66
MEN1 O00255 3/20 0.66
GAA P10253 2/20 0.66
TDP1 Q9NUW8 2/20 0.66
MITF O75030 3/20 0.59
NPC1 O15118 1/20 0.59
XBP1 P17861 1/20 0.59
RAB9A P51151 1/20 0.59
ATM Q13315 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
ALDH1A1 P00352 3/20 0.56
PSMB1 P20618 2/20 0.56
PSMB5 P28074 2/20 0.56
PSMB2 P49721 2/20 0.56

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
SCHEMBL19625588 0.87 MAPT (0.68) MAPTKMT2AHTTMAPK1NPSR1
SCHEMBL16297045 0.87 KMT2A (0.68) MAPTKMT2AHTTMAPK1NPSR1
SCHEMBL2241314 0.82 KMT2A (0.71) MAPTKMT2AHTTMAPK1NPSR1
SCHEMBL16303882 0.79 NAT1 (1.00) MAPTKMT2AHTTMAPK1NPSR1
SCHEMBL16296760 0.79 NAT1 (0.66) MAPTKMT2AMAPK1NAT1LMNA
SCHEMBL17742954 0.79 MAPT (0.55) MAPTKMT2AHTTMAPK1NPSR1
SCHEMBL16296667 0.78 NAT1 (0.81) MAPTKMT2AMAPK1NAT1LMNA
SCHEMBL16297166 0.78 MAPT (0.57) MAPTKMT2AHTTMAPK1NPSR1
SCHEMBL16297044 0.77 NAT1 (0.70) MAPTKMT2AHTTMAPK1NAT1
SCHEMBL17739600 0.76 MAPT (0.52) MAPTKMT2AHTTMAPK1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220128562-A1 BIOMARKERS PREDICTIVE OF CANCER CELL RESPONSE TO ML329 OR A DERIVATIVE THEREOF UNIVERSITY OF KANSAS 2022-04-28 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-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
WO-2011055142-A2 1,4-QUINONES AND THEIR SULFUR ANALOGUES USEFUL AS LIGANDS OF N-ACETYLTRANSFERASES ISIS INNOVATION LIMITED (GB) 2011-05-12 WO disclosed
WO-2011055142-A2 1,4-QUINONES AND THEIR SULFUR ANALOGUES USEFUL AS LIGANDS OF N-ACETYLTRANSFERASES ISIS INNOVATION LIMITED (GB) 2011-05-12 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-20160130222-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY MITF, TFEB, TYR MAPT 4100/4885KMT2A 2018/4885HTT 1337/4885
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY MITF, TFEB, TYR MAPT 4092/4885KMT2A 2146/4885HTT 1443/4885
US-20220128562-A1 BIOMARKERS PREDICTIVE OF CANCER CELL RESPONSE TO ML329 OR A DERIVATIVE THEREOF NQO1, KEAP1, NFE2L2 MAPT 3766/4885KMT2A 1107/4885HTT 4140/4885

“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.