SCHEMBL9634898

SCHEMBL9634898

C=[N+]([O-])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
SCHEMBL7698328 0.72
Propane SCHEMBL11448096 0.70
Nitroethane SCHEMBL27435792 0.67
SCHEMBL2881139 0.67
SCHEMBL9977946 0.67
SCHEMBL2880070 0.67
SCHEMBL83415 0.64
SCHEMBL16982021 0.64
SCHEMBL3498765 0.64
Nitroethane SCHEMBL35035 0.64

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 17 patents. 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
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
WO-2012082350-A1 PROTECTED ANTIMICROBIAL COMPOUNDS FOR HIGH TEMPERATURE APPLICATIONS ANGUS CHEMICAL COMPANY (US) 2012-06-21 WO claimed
EP-0283243-B1 CONTROL OF CORROSION IN AQUEOUS SYSTEMS W.R. Grace & Co.-Conn. (US) 1992-06-10 EP 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
US-7317063-B2 Phenolic resins ANGUS CHEMICAL COMPANY (US) 2008-01-08 US disclosed
US-20070055041-A1 Novel phenolic resins SWEDO RAYMOND J 2007-03-08 US disclosed
US-4910340-A Catalytic method for preparing symmetrical and nonsymmetrical dialkylhydroxylamines W. R. GRACE & CO.-CONN. (US) 1990-03-20 US disclosed
EP-0121701-B1 PROCESS FOR THE PRODUCTION OF O-SUBSTITUTED OXIMES ALLIED CORPORATION (US) 1988-08-24 EP disclosed
EP-0121701-A1 Process for the production of o-substituted oximes ALLIED CORPORATION (US) 1984-10-17 EP disclosed