SCHEMBL7698328

SCHEMBL7698328

C=[N+]([O-])CCC

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
SCHEMBL4880978 0.78
SCHEMBL5615699 0.78 ALDH1A1 (0.59)
SCHEMBL1273861 0.78 ALDH1A1 (0.59)
SCHEMBL9634898 0.72
SCHEMBL7691696 0.69
SCHEMBL16711580 0.67
Hydrochloric Acid SCHEMBL11195799 0.67
SCHEMBL14341635 0.64
SCHEMBL195349 0.64
SCHEMBL15477160 0.62 ALDH1A1 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2629608-B1 PROTECTED ANTIMICROBIAL COMPOUNDS FOR HIGH TEMPERATURE APPLICATIONS DOW GLOBAL TECHNOLOGIES LLC (US) 2016-07-13 EP claimed
US-9226499-B2 Protected antimicrobial compounds for high temperature applications DOW GLOBAL TECHNOLOGIES LLC (US) 2016-01-05 US claimed
CN-103260404-B Protected antimicrobial compounds for high temperature applications DOW GLOBAL TECHNOLOGIES INC 2015-04-01 CN claimed
US-20130267604-A1 PROTECTED ANTIMICROBIAL COMPOUNDS FOR HIGH TEMPERATURE APPLICATIONS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-10-10 US claimed
EP-2629608-A1 PROTECTED ANTIMICROBIAL COMPOUNDS FOR HIGH TEMPERATURE APPLICATIONS ANGUS Chemical Company (US) 2013-08-28 EP claimed
CN-103260404-A Protected antimicrobial compounds for high temperature applications ANGUS CHEMICAL COMPNAY 2013-08-21 CN claimed
WO-2012082350-A1 PROTECTED ANTIMICROBIAL COMPOUNDS FOR HIGH TEMPERATURE APPLICATIONS ANGUS CHEMICAL COMPANY (US) 2012-06-21 WO claimed
EP-2629608-B1 PROTECTED ANTIMICROBIAL COMPOUNDS FOR HIGH TEMPERATURE APPLICATIONS DOW GLOBAL TECHNOLOGIES LLC (US) 2016-07-13 EP disclosed
US-9226499-B2 Protected antimicrobial compounds for high temperature applications DOW GLOBAL TECHNOLOGIES LLC (US) 2016-01-05 US disclosed
US-9226499-B2 Protected antimicrobial compounds for high temperature applications DOW GLOBAL TECHNOLOGIES LLC (US) 2016-01-05 US disclosed
US-20130267604-A1 PROTECTED ANTIMICROBIAL COMPOUNDS FOR HIGH TEMPERATURE APPLICATIONS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-10-10 US disclosed
US-20130267604-A1 PROTECTED ANTIMICROBIAL COMPOUNDS FOR HIGH TEMPERATURE APPLICATIONS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-10-10 US disclosed
US-7319130-B2 Phenolic resins ANGUS CHEMICAL COMPANY (US) 2008-01-15 US disclosed
EP-1263833-A1 ROMP WITH OLIGOMERIC UV-ABSORBERS Ciba SC Holding AG (CH) 2002-12-11 EP disclosed
US-6310092-B1 TREATING SYSTEMIC LUPUS, MULTIPLE SCLEROSIS, RHEUMATOID ARTHRITIS, SEPTIC SHOCK, ERYTHEMA NODOSUM LEPROSY, SEPTICEMIA, UVEITIS, ADULT RESPIRATORY DISTRESS SYNDROME OR INFLAMMATORY BOWEL DISEASE CENTAUR PHARMACEUTICALS, INC. 2001-10-30 US disclosed
WO-2001062821-A1 ROMP WITH OLIGOMERIC UV-ABSORBERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-08-30 WO disclosed
US-6127408-A THIOETHER FURAN NITRONE COMPOUNDS; NERVOUS SYSTEM DEGENERATIVE DISORDERS, E.G. ALZHEIMER'S DISEASE; ANALYSIS OF FREE RADICALS BY FORMING ADDUCTS; INHIBIT THE FORMING OF A BETA(1-42) BETA-PLEATED SHEETS AND/OR SUPPRESSING CYTOKINES CENTAUR PHARMACEUTICALS, INC. (US) 2000-10-03 US disclosed
US-5998469-A NERVOUS SYSTEM DIOSRDERS; AUTOIMMUNE DISEASES; ANTIINFLAMMATORY AGENTS CENTAUR PHARMACEUTICALS, INC. (US) 1999-12-07 US disclosed
EP-0910370-A1 COMPOSITIONS COMPRISING A NITRONE COMPOUND FOR USE IN TREATING OCULAR INFLAMMATION CENTAUR PHARMACEUTICALS, INC. (US) 1999-04-28 EP disclosed
WO-1997039751-A1 COMPOSITIONS COMPRISING A NITRONE COMPOUND FOR USE IN TREATING OCULAR INFLAMMATION CENTAUR PHARMACEUTICALS, INC. (US) 1997-10-30 WO disclosed