SCHEMBL5403897

SCHEMBL5403897

c1cc(Nc2nnnnc2-c2c[nH]nn2)nnn1

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
SCHEMBL5397948 0.77
SCHEMBL6289165 0.75
SCHEMBL2086503 0.69
SCHEMBL10948448 0.68 GOT1 (0.31)
SCHEMBL27831600 0.66 GOT1 (0.30)
SCHEMBL11353371 0.63
SCHEMBL14776043 0.62
SCHEMBL28615041 0.61
SCHEMBL22576375 0.60
SCHEMBL10382990 0.60 MAPK10 (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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6602366-B2 Metal complexes; for smokeless fireworks THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2003-08-05 US claimed
US-20030069247-A1 1,2,4-triazolo[4,3-a][1,3,5]triazine-3,5,7-substituted precursor, and process, and compounds therefrom NAVY, UNITED STATES OF AMERICA, THE, AS REPRESENTED BY THE SECRETARY 2003-04-10 US claimed
US-20030013877-A1 Triazolyl-tetrazinyl-aminotriazine compounds useful in pyrotechnic compositions and process thereof KOPPES WILLIAM M (US) 2003-01-16 US claimed
WO-2002098855-A2 1,2,4-TRIAZOLO[4,3-a][1,3,5]TRIAZINE-3,5,7-SUBSTITUTED PRECURSOR, AND PROCESS, AND COMPOUNDS THEREFROM MCDONNELL THOMAS E (US) 2002-12-12 WO claimed
US-7220328-B1 Low-smoke gas generating low order pressure pulse compositions THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2007-05-22 US disclosed
US-6846926-B1 Triazolyl-aminotriazine compositions, including salts THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2005-01-25 US disclosed
US-6673924-B2 EXPLOSIVES; PYROTECHNICS; CYCLIZATION OF DICYANDIAMIDE WITH HYDRAZINE HYDROCHLORIDE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2004-01-06 US disclosed
US-6673924-B2 EXPLOSIVES; PYROTECHNICS; CYCLIZATION OF DICYANDIAMIDE WITH HYDRAZINE HYDROCHLORIDE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2004-01-06 US disclosed
US-6632305-B2 Chemical intermediates for use in explosives/pyrotechnics, herbicides, pesticides, fungicides and fertilizers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2003-10-14 US disclosed
US-6632305-B2 Chemical intermediates for use in explosives/pyrotechnics, herbicides, pesticides, fungicides and fertilizers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2003-10-14 US disclosed
US-6602366-B2 Metal complexes; for smokeless fireworks THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2003-08-05 US disclosed
US-6602366-B2 Metal complexes; for smokeless fireworks THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2003-08-05 US disclosed
WO-2002098855-A3 1,2,4-TRIAZOLO[4,3-a][1,3,5]TRIAZINE-3,5,7-SUBSTITUTED PRECURSOR, AND PROCESS, AND COMPOUNDS THEREFROM MCDONNELL THOMAS E (US) 2003-03-13 WO disclosed
US-20030013878-A1 1,2,4-triazolo[4,3-a][1,3,5]triazine-3,5,7-substituted precursor, and process, and compounds therefrom NAVY, UNITED STATES OF AMERICA, THE, AS REPRESENTED BY THE SECRETARY OF 2003-01-16 US disclosed
US-20030013878-A1 1,2,4-triazolo[4,3-a][1,3,5]triazine-3,5,7-substituted precursor, and process, and compounds therefrom NAVY, UNITED STATES OF AMERICA, THE, AS REPRESENTED BY THE SECRETARY OF 2003-01-16 US disclosed
US-20030013877-A1 Triazolyl-tetrazinyl-aminotriazine compounds useful in pyrotechnic compositions and process thereof KOPPES WILLIAM M (US) 2003-01-16 US disclosed
US-20030013877-A1 Triazolyl-tetrazinyl-aminotriazine compounds useful in pyrotechnic compositions and process thereof KOPPES WILLIAM M (US) 2003-01-16 US disclosed
US-20030013877-A1 Triazolyl-tetrazinyl-aminotriazine compounds useful in pyrotechnic compositions and process thereof KOPPES WILLIAM M (US) 2003-01-16 US disclosed
WO-2002098855-A2 1,2,4-TRIAZOLO[4,3-a][1,3,5]TRIAZINE-3,5,7-SUBSTITUTED PRECURSOR, AND PROCESS, AND COMPOUNDS THEREFROM MCDONNELL THOMAS E (US) 2002-12-12 WO disclosed
WO-2002098855-A2 1,2,4-TRIAZOLO[4,3-a][1,3,5]TRIAZINE-3,5,7-SUBSTITUTED PRECURSOR, AND PROCESS, AND COMPOUNDS THEREFROM MCDONNELL THOMAS E (US) 2002-12-12 WO disclosed