Ether

Ether

SCHEMBL1094032

CCOCC.O=c1ccc2nc3ccc(O)cc3oc-2c1

nearest known ligand 0.80

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APP P05067 13/20 0.80
CYP1A2 P05177 1/20 0.66
SNCA P37840 1/20 0.40
ESR1 P03372 3/20 0.40
ESR2 Q92731 3/20 0.40
PDE4D Q08499 1/20 0.39
MIF P14174 1/20 0.38
PFKFB3 Q16875 1/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
PLEC Q15149 1/20 0.38

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
Alcohol SCHEMBL6810203 0.91 APP (0.86) APPCYP1A2SNCAESR1ESR2
Methoxymethane SCHEMBL2784008 0.90 APP (0.89) APPCYP1A2SNCAESR1ESR2
SCHEMBL8066 0.89 APP (1.00) APPCYP1A2SNCAESR1ESR2
SCHEMBL29456578 0.88 APP (0.97) APPCYP1A2SNCAESR1ESR2
SCHEMBL1095367 0.88 APP (0.97) APPCYP1A2SNCAESR1ESR2
SCHEMBL7113427 0.88 APP (0.97) APPCYP1A2SNCAESR1ESR2
Ammonia Solution, Strong SCHEMBL29419058 0.88 APP (0.97) APPCYP1A2SNCAESR1ESR2
Propionic Acid SCHEMBL21043901 0.88 APP (0.80) APPCYP1A2SNCAESR1ESR2
Propionic Acid SCHEMBL21043899 0.88 APP (0.80) APPCYP1A2SNCAESR1ESR2
Acetic Acid SCHEMBL233000 0.86 APP (0.86) APPCYP1A2SNCAESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106544399-B Application of high-specificity fluorescent probe for detecting cytochrome P4501A1 苏州尚稷电子科技有限公司 2020-04-03 CN claimed
CN-106544399-A The application of the high specific fluorescence probe of one class detection Cytochrome P450 1A1 苏州尚稷电子科技有限公司 2017-03-29 CN claimed
WO-1994019487-A1 ISOLATION OF TROPHOBLASTS APROGENEX, INC. (US) 1994-09-01 WO claimed
US-5110725-A Optical probe for the cytochrome P-450 cholesterol side chain cleavage enzyme THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1992-05-05 US claimed
US-20240219393-A1 ALUMINOSILICATE NANOPARTICLE SENSORS AND USES THEREOF CORNELL UNIVERSITY 2024-07-04 US disclosed
US-20220162693-A1 MASSIVELY PARALLEL SEQUENCING USING UNLABELED NUCLEOTIDES MGI TECH CO., LTD. (CN) 2022-05-26 US disclosed
EP-3877548-A1 MASSIVELY PARALLEL SEQUENCING USING UNLABELED NUCLEOTIDES MGI Tech Co., Ltd. (CN) 2021-09-15 EP disclosed
US-20210246109-A1 POTENT AND SELECTIVE INHIBITORS OF CYTOCHROME P450 UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2021-08-12 US disclosed
CN-106544399-B Application of high-specificity fluorescent probe for detecting cytochrome P4501A1 苏州尚稷电子科技有限公司 2020-04-03 CN disclosed
EP-3269822-A1 METHODS AND COMPOSITIONS TO DETECT A BIOLOGICAL ACTIVITY 3M Innovative Properties Company (US) 2018-01-17 EP disclosed
EP-2643471-B1 METHODS AND COMPOSITIONS TO DETECT A BIOLOGICAL ACTIVITY 3M INNOVATIVE PROPERTIES CO (US) 2017-08-30 EP disclosed
WO-2017125754-A1 ELECTRONIC BIOSENSOR DE MONTFORT UNIVERSITY (GB) 2017-07-27 WO disclosed
US-6420130-B1 CHEMICAL COMPOUND FOR USE IN THE DETECTION OF PREFERENTIAL ENZYMATIC POLYPEPTIDE AURORA BIOSCIENCES CORPORATION 2002-07-16 US disclosed
EP-1140888-A1 OPTICAL MOLECULAR SENSORS FOR CYTOCHROME P450 ACTIVITY Aurora Biosciences Corporation (US) 2001-10-10 EP disclosed
US-6143492-A COMPOUND USEFUL AS AN OPTICAL PROBE; DRUG SCREENING AURORA BIOSCIENCES CORPORATION (US) 2000-11-07 US disclosed
WO-2000035900-A1 OPTICAL MOLECULAR SENSORS FOR CYTOCHROME P450 ACTIVITY AURORA BIOSCIENCES CORPORATION (US) 2000-06-22 WO disclosed
US-5811389-A INHIBITING PLATELET AGGREGATION; BLOOD DISORDERS HOFFMANN-LA ROCHE INC. (US) 1998-09-22 US disclosed
US-5811548-A USEFUL AS RESEARCH TOOLS IN THE DETERMINATION OF BIOLOGICALLY ACTIVE PEPTIDE SEQUENCES HOFFMANN-LA ROCHE INC. (US) 1998-09-22 US disclosed
US-5208332-A Optical probe for the cytochrome P-450 cholesterol side chain cleavage enzyme THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1993-05-04 US disclosed
US-5110725-A Optical probe for the cytochrome P-450 cholesterol side chain cleavage enzyme THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1992-05-05 US 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-20210246109-A1 POTENT AND SELECTIVE INHIBITORS OF CYTOCHROME P450 CYP11B1, CYP1B1, CYP27A1 APP 4214/4885CYP1A2 18/4885SNCA 3205/4885

“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.