SCHEMBL4944214

SCHEMBL4944214

[CH]=CC=CN(CC)CC

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL4944210 1.00
SCHEMBL2142076 0.73
SCHEMBL10598388 0.73
SCHEMBL10598393 0.73
SCHEMBL9308144 0.71
SCHEMBL2984474 0.71
SCHEMBL9308137 0.71
SCHEMBL2984476 0.71
SCHEMBL4711628 0.67
SCHEMBL8533228 0.67 ALDH1A1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6376523-B1 HYPOTENSIVE AGENTS; ANTIINFLAMMATORY AGENTS; ENDOGENOUS VASOCONSTRUCTION PEPTIDE TEXAS BIOTECHNOLOGY CORPORATION 2002-04-23 US claimed
US-20010036958-A1 Benzenesulfonamides and the use thereof to modulate the activity of endothelin ENCYSIVE PHARMACEUTICALS, INC. 2001-11-01 US claimed
US-5514691-A N-(4-halo-isoxazolyl)-sulfonamides and derivatives thereof that modulate the activity of endothelin IMMUNOPHARMACEUTICS, INC. (US) 1996-05-07 US claimed
US-7459317-B2 Method for detecting an analyte in a sample ALVERIX, INC. (US) 2008-12-02 US disclosed
US-20080003622-A1 Methods for detecting an analyte in a sample AVAGO TECHNOLOGIES GENERAL IP (SINGAPORE) PTD. LTD. (SG) 2008-01-03 US disclosed
US-20080003621-A1 Method for Detecting an Analyte in a Sample AVAGO TECHNOLOGIES GENERAL IP (SINGAPORE) PTD. LTD. (SG) 2008-01-03 US disclosed
US-7226752-B1 Methods for detecting an analyte in a sample AVAGO TECHNOLOGIES GENERAL IP (SINGAPORE) PTE. LTD. (SG) 2007-06-05 US disclosed
US-6322992-B1 CONTACTING FLUID SAMPLE SUSPECTED OF CONTAINING SPECIFIC BINDING LIGAND WITH AN ANALYTIC ELEMENT CONTAINING VANADIUM BROMOPEROXIDASE-LABELED LIGAND OR ANALOG, AND IMMOBILIZED RECEPTOR THAT BINDS LIGAND OR ANALOG; APPLYING WASH SOLUTION JOHNSON & JOHNSON CLINICAL DIAGNOSTICS, INC. 2001-11-27 US disclosed
EP-0892855-B1 USE OF VANADIUM BROMOPEROXIDASE AS A SIGNAL-GENERATING ENZYME FOR CHEMILUMINESCENT SYSTEMS: TEST KITS AND ANALYTICAL METHODS ORTHO CLINICAL DIAGNOSTICS INC (US) 2001-11-07 EP disclosed
EP-0653637-B1 Dry elements, test devices, test kits and methods for chemiluminescent detection of analytes using peroxidase labeled reagents EASTMAN KODAK CO (US) 2001-05-30 EP disclosed
EP-0848819-B1 ANALYTICAL ELEMENT AND METHOD FOR THE DETERMINATION OF A SPECIFIC BINDING LIGAND USING A VANADIUM BROMOPEROXIDASE AS A SIGNAL-GENERATING ENZYME ORTHO CLINICAL DIAGNOSTICS INC (US) 2000-04-26 EP disclosed
WO-1997009447-A1 USE OF VANADIUM BROMOPEROXIDASE AS A SIGNAL-GENERATING ENZYME FOR CHEMILUMINESCENT SYSTEMS: TEST KITS AND ANALYTICAL METHODS JOHNSON & JOHNSON CLINICAL DIAGNOSTICS, INC. (US) 1997-03-13 WO disclosed
WO-1997009619-A1 ANALYTICAL ELEMENT AND METHOD FOR THE DETERMINATION OF A SPECIFIC BINDING LIGAND USING A VANADIUM BROMOPEROXIDASE AS A SIGNAL-GENERATING ENZYME JOHNSON & JOHNSON CLINICAL DIAGNOSTICS, INC. (US) 1997-03-13 WO disclosed
EP-0653637-A2 Dry elements, test devices, test kits and methods for chemiluminescent detection of analytes using peroxidase labeled reagents EASTMAN KODAK COMPANY (US) 1995-05-17 EP disclosed
US-5372931-A Use of 4'-hydroxy- and 4'-alkoxy-substituted electron transfer agents in compositions, elements, test kits and analytical methods EASTMAN KODAK COMPANY (US) 1994-12-13 US disclosed
US-5372932-A Peroxidase-labeled immunoreactant; stabiliztion with a 4-hydroxy or 4-alkoxyarylacetamide EASTMAN KODAK COMPANY (US) 1994-12-13 US disclosed
EP-0603953-A1 Use of 4' of 5'-hydroxy and 4'- or 5'-alkoxy-substituted electron transfer agents in compositions, elements, test kits and analytical methods Johnson &amp; Johnson Clinical Diagnostics, Inc. (US) 1994-06-29 EP disclosed
EP-0603954-A2 Analytical element and immunoassay using a 4-hydroxy or 4-alkoxyarylacetamide as stabilizer Johnson &amp; Johnson Clinical Diagnostics, Inc. (US) 1994-06-29 EP disclosed
EP-0582339-A2 Chemiluminescent composition containing cationic surfactants or polymers and 4'hydroxyacetanilide, test kits and their use in analytical methods Johnson &amp; Johnson Clinical Diagnostics, Inc. (US) 1994-02-09 EP disclosed
US-5279940-A Containing 2,3-dihydro-1,4-phthalazinedione, cationic surfactant, and 4*-hydroxyacetanilide EASTMAN KODAK COMPANY (US) 1994-01-18 US disclosed