SCHEMBL16296992

SCHEMBL16296992

O=C1C(Cl)=C(NS(=O)(=O)c2ccc(Br)s2)C(=O)c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.51
KMT2A Q03164 8/20 0.50
MAPT P10636 5/20 0.50
HTT P42858 5/20 0.50
MAPK1 P28482 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
LMNA P02545 7/20 0.48
ALDH1A1 P00352 5/20 0.48
TSHR P16473 2/20 0.48
MEN1 O00255 7/20 0.47
TP53 P04637 1/20 0.47
POLB P06746 2/20 0.45
MITF O75030 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
GAA P10253 1/20 0.45
XBP1 P17861 1/20 0.45
RAB9A P51151 1/20 0.45
ATM Q13315 1/20 0.45
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL19625586 0.83 MAPT (0.50) KMT2AMAPTHTTMAPK1NPSR1
SCHEMBL16296830 0.83 THRB (0.51) THRBKMT2AMAPTHTTMAPK1
SCHEMBL16297166 0.78 MAPT (0.57) KMT2AMAPTHTTMAPK1NPSR1
SCHEMBL16297080 0.76 MEN1 (0.66) KMT2AMAPTHTTMAPK1NPSR1
SCHEMBL16297045 0.75 KMT2A (0.68) KMT2AMAPTHTTMAPK1NPSR1
SCHEMBL16296689 0.75 MAPT (0.55) KMT2AMAPTHTTMAPK1NPSR1
SCHEMBL16296929 0.74 MAPT (0.71) KMT2AMAPTHTTMAPK1NPSR1
SCHEMBL16296707 0.74 MAPT (0.72) KMT2AMAPTHTTMAPK1NPSR1
SCHEMBL1815994 0.74 MAPT (0.71) KMT2AMAPTHTTMAPK1NPSR1
SCHEMBL26010796 0.72 LMNA (0.62) THRBKMT2AMAPTHTTMAPK1

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 THRB 387/4885KMT2A 2018/4885MAPT 4100/4885
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY MITF, TFEB, TYR THRB 380/4885KMT2A 2146/4885MAPT 4092/4885

“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.