SCHEMBL147963

SCHEMBL147963

COc1ccc(N=O)c(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 3/20 0.59
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
CA14 Q9ULX7 1/20 0.56
ALDH1A1 P00352 7/20 0.50
CYP3A4 P08684 2/20 0.48
CYP1A1 P04798 2/20 0.48
CYP1A2 P05177 2/20 0.48
KMT2A Q03164 6/20 0.48
MAPT P10636 5/20 0.48
NPC1 O15118 2/20 0.48
PKM P14618 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HPGD P15428 2/20 0.45
MEN1 O00255 5/20 0.44
GAA P10253 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
SCHEMBL30892213 0.83 CA12 (0.56) CYP1B1CA12CA1CA2CA7
SCHEMBL12463621 0.83 CA12 (0.56) CYP1B1CA12CA1CA2CA7
SCHEMBL11933957 0.83 CYP1B1 (0.44) CYP1B1CA12CA1CA2CA7
SCHEMBL14074156 0.81 HPGD (0.63) CYP1B1CA12CA1CA2CA9
SCHEMBL1547455 0.81 CA12 (0.58) CYP1B1CA12CA1CA2CA7
SCHEMBL9970729 0.81 TUBB4A (0.46) CYP1B1CA12CA1CA2CA7
SCHEMBL8421873 0.79 SMN1; SMN2 (0.42) CYP1B1CA12CA1CA2CA7
SCHEMBL13888877 0.79 ACHE (0.56) CYP1B1ALDH1A1CYP3A4KMT2AMAPT
SCHEMBL22281456 0.79 CYP1B1 (0.42) CYP1B1CA12CA1CA2CA7
SCHEMBL10279315 0.79 CA12 (0.56) CYP1B1CA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11851685-B2 Zwitterion buffer containing compositions and uses in electroanalytical devices and methods ROCHE DIABETES CARE, INC. (US) 2023-12-26 US claimed
US-5858691-A Method and agent for the simultaneous colorimetric and electrochemical measurement of an analyte BOEHRINGER MANNHEIM GMBH (DE) 1999-01-12 US claimed
EP-4481375-A2 DETECTION REAGENTS AND ELECTRODE ARRANGEMENTS FOR MULTI-ANALYTE DIAGNOSTIC TEST ELEMENTS, AS WELL AS METHODS OF USING THE SAME F. Hoffmann-La Roche AG (CH) 2024-12-25 EP disclosed
EP-3523639-B1 DETECTION REAGENTS AND ELECTRODE ARRANGEMENTS FOR MULTI-ANALYTE DIAGNOSTIC TEST ELEMENTS, AS WELL AS METHODS OF USING THE SAME HOFFMANN LA ROCHE (CH) 2024-12-18 EP disclosed
US-20240327892-A1 DETECTION REAGENTS AND ELECTRODE ARRANGEMENTS FOR MULTI-ANALYTE DIAGNOSTIC TEST ELEMENTS, AS WELL AS METHODS OF USING THE SAME ROCHE DIABETES CARE, INC. 2024-10-03 US disclosed
US-12024735-B2 Detection reagents and electrode arrangements for multi-analyte diagnostic test elements, as well as methods of using the same ROCHE DIABETES CARE, INC. (US) 2024-07-02 US disclosed
US-11851685-B2 Zwitterion buffer containing compositions and uses in electroanalytical devices and methods ROCHE DIABETES CARE, INC. (US) 2023-12-26 US disclosed
EP-4152003-A1 SYSTEMS AND METHODS FOR MULTIPLE ANALYTE ANALYSIS Roche Diabetes Care GmbH (DE) 2023-03-22 EP disclosed
EP-3757574-B1 SYSTEMS AND METHODS FOR MULTIPLE ANALYTE ANALYSIS ROCHE DIABETES CARE GMBH (DE) 2022-12-07 EP disclosed
US-20220275348-A1 ZWITTERION BUFFER CONTAINING COMPOSITIONS AND USES IN ELECTROANALYTICAL DEVICES AND METHODS ROCHE DIABETES CARE, INC. 2022-09-01 US disclosed
US-20220098636-A1 DETECTION REAGENTS AND ELECTRODE ARRANGEMENTS FOR MULTI-ANALYTE DIAGNOSTIC TEST ELEMENTS, AS WELL AS METHODS OF USING THE SAME ROCHE DIABETES CARE, INC. (US) 2022-03-31 US disclosed
EP-0441222-B1 Process and electrode system for determining an analyte or an oxidoreductase as well as suitable compounds BOEHRINGER MANNHEIM GMBH (DE) 1996-12-18 EP disclosed
US-5484708-A DETERMINATION OF GLUCOSE BOEHRINGER MANNHEIM GMBH (DE) 1996-01-16 US disclosed
CN-1098745-A Method with PQQ-dependent dehydrogenase colorimetric estimation analyte BOEHRINGER MANNHEIM GMBH (DE) 1995-02-15 CN disclosed
EP-0620283-A1 Method for colourimetric determination of an analyte by using a PQQ-dependent dehydrogenase Roche Diagnostics GmbH (DE) 1994-10-19 EP disclosed
CN-1026248-C Method and sensing electrode system for electrochemical determination of analytes and oxidoreductases BOEHRINGER MANNHEIM GMBH 1994-10-19 CN disclosed
US-5286362-A Reducible substance is enzymatically reduced and oxidized at the electrode; substance formed by oxidation is different from the reducible substance used initially BOEHRINGER MANNHEIM GMBH (DE) 1994-02-15 US disclosed
US-5122244-A Having a reducible nitroso or oxime compound to transfer electrons leading to a signal and form an aromatic amine oxidizable to a compound different from the original; low voltage BOEHRINGER MANNHEIM GMBH (DE) 1992-06-16 US disclosed
CN-1054666-A Be used for the method for electrochemical determination of analyte or oxidoreducing enzyme and sensitive electrode system and for this reason and the compound that uses BOEHRINGER MANNHEIM GMBH (DE) 1991-09-18 CN disclosed
EP-0441222-A2 Process and electrode system for determining an analyte or an oxidoreductase as well as suitable compounds Roche Diagnostics GmbH (DE) 1991-08-14 EP disclosed