SCHEMBL438196

SCHEMBL438196

O=[N+]([O-])N=C1NCNCN1

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
Hydrochloric Acid SCHEMBL9138615 0.98
SCHEMBL28277049 0.81
SCHEMBL436234 0.80
SCHEMBL14483428 0.79
SCHEMBL7981825 0.76
SCHEMBL8373451 0.76 FKBP5 (0.32)
SCHEMBL5392712 0.74
SCHEMBL2811287 0.71
SCHEMBL7502293 0.71
SCHEMBL12973172 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0483055-A1 Triazacyclohexane derivatives CIBA-GEIGY AG (CH) 1992-04-29 EP claimed
CN-1060468-A TRIANACYCLOHEXANE DERIVATIVES CIBA GEIGY AG (CH) 1992-04-22 CN claimed
JP-2289552-A None JP disclosed
JP-9227532-A None JP disclosed
JP-11236381-A None JP disclosed
JP-4330049-A None JP disclosed
US-20260107951-A1 COMPOSITIONS AND METHODS RELATING TO INSECTICIDES UNIV FLORIDA (US) 2026-04-23 US disclosed
US-12501902-B2 Compositions and methods relating to insecticides UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2025-12-23 US disclosed
US-20220264897-A1 COMPOSITIONS AND METHODS RELATING TO INSECTICIDES UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2022-08-25 US disclosed
WO-2021041278-A2 COMPOSITIONS AND METHODS RELATING TO INSECTICIDES UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2021-03-04 WO disclosed
WO-2020198414-A1 COMPOSITIONS AND METHODS RELATING TO INSECTICIDES UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2020-10-01 WO disclosed
EP-0483062-B1 Process for the preparation of nitroguanidine derivatives CIBA GEIGY AG (CH) 1996-09-18 EP disclosed
US-5391736-A Nitrating 2-nitroimino-hexahydro or -5-nitrohexahydro-1,3,5-triazine with nitric acid and trifluoroacetic anhydride in presence of nitromethane at low temperature GENCORP AEROJET (US) 1995-02-21 US disclosed
US-5391736-A Nitrating 2-nitroimino-hexahydro or -5-nitrohexahydro-1,3,5-triazine with nitric acid and trifluoroacetic anhydride in presence of nitromethane at low temperature GENCORP AEROJET (US) 1995-02-21 US disclosed
US-5245040-A PROCESS FOR THE PREPARATION OF NITROGUANIDINE DERIVATIVES CIBA-GEIGY CORPORATION (US) 1993-09-14 US disclosed
JP-H04330049-A PRODUCTION OF NITROGUANIDINE DERIVATIVE CIBA GEIGY AG 1992-11-18 JP disclosed
EP-0483055-A1 Triazacyclohexane derivatives CIBA-GEIGY AG (CH) 1992-04-29 EP disclosed
US-4983734-A REACTING HEXAMETHYLENETETRAMINE WITH NITROGUANIDINE ACID SALT FORMATION AEROJET GENERAL CORPORATION (US) 1991-01-08 US disclosed
JP-H02289552-A HIGH ENERGY INSENSITIVE CYCLIC NITRAMINE AEROJET GENERAL CORP 1990-11-29 JP disclosed
US-4937340-A ROCKET AND GUN PROPELLANTS AND EXPLOSIVES AEROJET-GENERAL CORPORATION (US) 1990-06-26 US disclosed