SCHEMBL2180857

SCHEMBL2180857

CCSCCOP(=O)(OCCSCC)SCCSCC

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
CYP3A4 P08684 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
MVD P53602 1/20 0.30

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
Demeton S SCHEMBL6732303 0.85 ALDH1A1 (0.59) ALDH1A1CYP3A4HSD17B10MEN1KMT2A
Demeton S SCHEMBL117918 0.85 ALDH1A1 (0.59) ALDH1A1CYP3A4HSD17B10MEN1KMT2A
SCHEMBL1202631 0.83 ALDH1A1 (0.47) ALDH1A1CYP3A4HSD17B10MEN1KMT2A
Demeton S SCHEMBL117917 0.83 MEN1 (0.72) ALDH1A1CYP3A4HSD17B10MEN1KMT2A
Demeton S SCHEMBL21437107 0.81 MEN1 (0.68) ALDH1A1CYP3A4HSD17B10MEN1KMT2A
Demeton S SCHEMBL6047157 0.81 MEN1 (0.58) ALDH1A1CYP3A4HSD17B10MEN1KMT2A
Demeton-S-Methyl SCHEMBL5917224 0.79 MEN1 (0.53) ALDH1A1CYP3A4HSD17B10MEN1KMT2A
Demeton S SCHEMBL7254122 0.79 ALDH1A1 (0.52) ALDH1A1CYP3A4HSD17B10MEN1KMT2A
Demeton S SCHEMBL20544186 0.79 ALDH1A1 (0.52) ALDH1A1CYP3A4HSD17B10MEN1KMT2A
Demeton-S-Methyl SCHEMBL6741750 0.78 MAPT (0.52) ALDH1A1CYP3A4HSD17B10MEN1KMT2A

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 64 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220410118-A1 COMPOSITES FOR CHEMICAL SEQUESTRATION DECONTAMINATION THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2022-12-29 US claimed
US-11433371-B2 Composites for chemical sequestration decontamination THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2022-09-06 US claimed
US-20190291072-A1 COMPOSITES FOR CHEMICAL SEQUESTRATION DECONTAMINATION THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2019-09-26 US claimed
EP-0268926-A2 Safened sorptive granular pesticidal resin compositions for controlling soil borne pests and process for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1988-06-01 EP claimed
EP-0268927-A2 Resin-coated, non-sorptive granular, pesticidal compositions and method for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1988-06-01 EP claimed
US-20220410118-A1 COMPOSITES FOR CHEMICAL SEQUESTRATION DECONTAMINATION THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2022-12-29 US disclosed
US-11433371-B2 Composites for chemical sequestration decontamination THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2022-09-06 US disclosed
US-20190291072-A1 COMPOSITES FOR CHEMICAL SEQUESTRATION DECONTAMINATION THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2019-09-26 US disclosed
US-20140162906-A1 Pesticide Biomarker NAGY JON OWEN (US) 2014-06-12 US disclosed
US-20110166043-A1 BIOMARKER DETECTION-2 ATERIS TECHNOLOGIES, LLC 2011-07-07 US disclosed
US-20100168030-A1 Methods and compositions for treatment of organophosphate-caused pathology ARMY, UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE 2010-07-01 US disclosed
US-20100041077-A1 PESTICIDE BIOMARKER ATERIS TECHNOLOGIES, LLC 2010-02-18 US disclosed
EP-0504812-A2 Aromatic compounds, their production processes and their compositions for the control of insect pests SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-09-23 EP disclosed
US-5137907-A Pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-08-11 US disclosed
EP-0488236-A1 Aromatic compounds, their production processes and their compositions for the control of insect pests SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-06-03 EP disclosed
EP-0484688-A1 Aromatic compounds, their production process and their compositions for the control of insect pests SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-05-13 EP disclosed
EP-0460472-A1 Carbamic acid derivatives, their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-12-11 EP disclosed
US-4822401-A FOR COTTON, CEREALS FMC CORPORATION (US) 1989-04-18 US disclosed
EP-0268927-A2 Resin-coated, non-sorptive granular, pesticidal compositions and method for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1988-06-01 EP disclosed
EP-0268925-A2 Safened pesticidal resin compositions for controlling soil borne pests and process for the preparation thereof AMERICAN CYANAMID COMPANY (US) 1988-06-01 EP 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 (1 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-20110166043-A1 BIOMARKER DETECTION-2 CPB2, NAALAD2, PRSS2 ALDH1A1 1052/4885CYP3A4 475/4885HSD17B10 118/4885

“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.