SCHEMBL990245

SCHEMBL990245

CN(C)S(=O)(=O)c1ccc(/N=N/c2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.58
CYP2D6 P10635 1/20 0.58
LMNA P02545 4/20 0.58
ALDH1A1 P00352 6/20 0.52
MAPK1 P28482 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
TSHR P16473 1/20 0.52
HSD17B10 Q99714 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.50
HTT P42858 1/20 0.50
MAPT P10636 4/20 0.49
CA12 O43570 3/20 0.49
CA9 Q16790 3/20 0.49
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
CA2 P00918 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HPGD P15428 1/20 0.47
BRD4 O60885 1/20 0.45

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
SCHEMBL11039288 0.83 CA12 (0.61) POLBLMNAALDH1A1TDP1TSHR
SCHEMBL11039286 0.83 CA12 (0.61) POLBLMNAALDH1A1TDP1TSHR
SCHEMBL29790508 0.83 NPC1 (0.69) POLBLMNAALDH1A1MAPK1TDP1
SCHEMBL182738 0.81 LMNA (0.67) LMNAALDH1A1TDP1SMN1; SMN2HTT
Water SCHEMBL28154432 0.79 LMNA (0.64) LMNAALDH1A1TDP1SMN1; SMN2HTT
Hydrochloric Acid SCHEMBL19211700 0.79 LMNA (0.64) LMNAALDH1A1TDP1SMN1; SMN2HTT
Hydrochloric Acid SCHEMBL1017218 0.79 LMNA (0.64) LMNAALDH1A1TDP1SMN1; SMN2HTT
SCHEMBL23555189 0.78 LMNA (0.63) POLBLMNAALDH1A1SMN1; SMN2HTT
SCHEMBL4073854 0.78 LMNA (0.63) LMNAALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL11798300 0.77 LMNA (0.62) LMNAALDH1A1TDP1SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178086-A1 REDUCTIVE RELEASE PROBES CONTAINING A CHEMOSELECTIVELY CLEAVABLE ALPHA-AZIDOETHER LINKER AND METHODS OF USE THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2012-07-12 US claimed
WO-2011005821-A1 REDUCTIVE RELEASE PROBES CONTAINING A CHEMOSELECTIVELY CLEAVABLE ALPHA-AZIDOETHER LINKER AND METHODS OF USE THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2011-01-13 WO claimed
US-7745614-B2 Universal linker compositions for the release or transfer of chemical agents from a polynucleotide THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2010-06-29 US claimed
US-20080124706-A1 Nucleic acid probe, nucleic acid chip, method for detecting target nucleic acid, method for screening drug, apparatus for detecting target nucleic acid, and, gene diagnosis method KYOTO UNIVERSITY (JP) 2008-05-29 US claimed
EP-1717313-A1 NUCLEIC ACID PROBE, NUCLEIC ACID CHIP, METHOD OF DETECTING TARGET NUCLEIC ACID, METHOD OF SCREENING DRUG, APPARATUS FOR DETECTING TARGET NUCLEIC ACID AND GENE DIAGNOSIS METHOD Kyoto University (JP) 2006-11-02 EP claimed
US-20060199192-A1 Universal linker compositions for the release or transfer of chemical agents from a polynucleotide THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2006-09-07 US claimed
US-9422232-B2 Reductive release probes containing a chemoselectively cleavable α-azidoether linker and methods of use thereof THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2016-08-23 US disclosed
US-9416155-B2 Direct sensing of molecular species by polyfluors on a DNA backbone THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2016-08-16 US disclosed
US-20120309107-A1 Direct Sensing of Molecular Species by Polyfluors on a DNA Backbone THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2012-12-06 US disclosed
US-20120178086-A1 REDUCTIVE RELEASE PROBES CONTAINING A CHEMOSELECTIVELY CLEAVABLE ALPHA-AZIDOETHER LINKER AND METHODS OF USE THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2012-07-12 US disclosed
WO-2011097437-A1 DOUBLE DISPLACEMENT PROBES FOR NUCLEIC ACID DETECTION THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2011-08-11 WO disclosed
WO-2011081939-A1 DIRECT SENSING OF MOLECULAR SPECIES BY POLYFLUORS ON A DNA BACKBONE THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2011-07-07 WO disclosed
WO-2011005821-A1 REDUCTIVE RELEASE PROBES CONTAINING A CHEMOSELECTIVELY CLEAVABLE ALPHA-AZIDOETHER LINKER AND METHODS OF USE THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2011-01-13 WO disclosed
US-7749699-B2 Detection of chemical ligation using fluorescence quenching leaving groups THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2010-07-06 US disclosed
US-7745614-B2 Universal linker compositions for the release or transfer of chemical agents from a polynucleotide THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2010-06-29 US disclosed
US-20060199192-A1 Universal linker compositions for the release or transfer of chemical agents from a polynucleotide THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2006-09-07 US disclosed
EP-1543156-A4 DETECTION OF CHEMICAL LIGATION USING FLUORESCENCE QUENCHING LEAVING GROUPS UNIV LELAND STANFORD JUNIOR (US) 2005-12-21 EP disclosed
EP-1543156-A2 DETECTION OF CHEMICAL LIGATION USING FLUORESCENCE QUENCHING LEAVING GROUPS The Board of Trustees of the Leland Stanford Junior University (US) 2005-06-22 EP disclosed
US-20040259102-A1 DETECTION OF CHEMICAL LIGATION USING FLUORESCENCE QUENCHING LEAVING GROUPS STANFORD UNIVERSITY (US) 2004-12-23 US disclosed
WO-2004010101-A2 DETECTION OF CHEMICAL LIGATION USING FLUORESCENCE QUENCHING LEAVING GROUPS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2004-01-29 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-20120309107-A1 Direct Sensing of Molecular Species by Polyfluors on a DNA Backbone ERCC4, POLL, POLQ POLB 19/4885CYP2D6 4335/4885LMNA 189/4885
US-20060199192-A1 Universal linker compositions for the release or transfer of chemical agents from a polynucleotide ADAR, POLRMT, RNGTT POLB 34/4885CYP2D6 4722/4885LMNA 207/4885
US-20120178086-A1 REDUCTIVE RELEASE PROBES CONTAINING A CHEMOSELECTIVELY CLEAVABLE ALPHA-AZIDOETHER LINKER AND METHODS OF USE THEREOF CPSF1, CPSF7, CPSF6 POLB 1071/4885CYP2D6 3782/4885LMNA 400/4885

“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.