SCHEMBL7558516

SCHEMBL7558516

C1CNC2NCCNC2N1

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
SCHEMBL660984 1.00
SCHEMBL11103590 1.00
SCHEMBL7563212 0.80 CXCR4 (0.33)
SCHEMBL16081442 0.74
SCHEMBL2176735 0.69
SCHEMBL13227939 0.67
SCHEMBL473647 0.65
SCHEMBL25316899 0.60
SCHEMBL1417919 0.60
SCHEMBL25315905 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0980360-B1 A PROCESS FOR THE PREPARATION OF 1,4,7,10-TETRAAZACYCLODODECANE BRACCO INT BV (NL) 2002-07-17 EP claimed
EP-0980360-A1 A PROCESS FOR THE PREPARATION OF 1,4,7,10-TETRAAZACYCLODODECANE BRACCO INTERNATIONAL B.V. (NL) 2000-02-23 EP claimed
US-5886174-A HYDROLYSIS OF DECAHYDRO-2A-4A-6A-8A-TETRAAZACYCLOPENT(FG)ACENAPHTHYLENE IN AQUEOUS SOLUTION IN SLIGHTLY ACIDIC OR BASIC OR NEUTRAL PH WITH PRIMARY AMINE DIBRA S.P.A. (IT) 1999-03-23 US claimed
WO-1998049151-A1 A PROCESS FOR THE PREPARATION OF 1,4,7,10-TETRAAZACYCLODODECANE BRACCO S.P.A. (IT) 1998-11-05 WO claimed
EP-0604250-B1 Use of decahydropyrazino 2,3-b pyrazine for reducing the amount of free or combined hydrogen sulfide contained in a fluid HOECHST FRANCE (FR) 1997-05-02 EP claimed
US-5417845-A Use of decahydro pyrazino [2,3-b] pyrazine for the reduction of the proportion of free or combined hydrogen sulphide present in a fluid SOCIETE FRANCAISE HOECHST (FR) 1995-05-23 US claimed
US-4814447-A Preparation of hydroxyalkylpiperazinones by reacting an alkylene oxide with decahydropyrazino[2,3-b]pyrazine or its substituted derivatives THE DOW CHEMICAL COMPANY (US) 1989-03-21 US claimed
US-4218559-A FUSED PYRAZINE COMPOUNDS AMERICAN CYANAMID COMPANY (US) 1980-08-19 US claimed
US-20250154114-A1 MATERIAL FOR METAL PATTERNING, HETEROCYCLIC COMPOUND, THIN FILM FOR METAL PATTERNING, ORGANIC ELECTROLUMINESCENT DEVICE, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN TOSOH CORPORATION (JP) 2025-05-15 US disclosed
CN-118696625-A Material for metal patterning, heterocyclic compound, thin film for metal patterning, organic electroluminescent element, electronic device, and method for forming metal pattern 东曹株式会社 2024-09-24 CN disclosed
WO-2023153482-A1 MATERIAL FOR METAL PATTERNING, HETEROCYCLIC COMPOUND, THIN FILM FOR METAL PATTERNING, ORGANIC ELECTROLUMINESCENT DEVICE, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN 東ソー株式会社 2023-08-17 WO disclosed
EP-3051577-B1 CLEANING AGENT FOR SEMICONDUCTOR SUBSTRATES AND METHOD FOR PROCESSING SEMICONDUCTOR SUBSTRATE SURFACE WAKO PURE CHEM IND LTD (JP) 2017-10-18 EP disclosed
US-20170152213-A1 AMINE-CONTAINING LIPIDOIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-06-01 US disclosed
US-9439968-B2 Amine-containing lipidoids and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-09-13 US disclosed
US-4814447-A Preparation of hydroxyalkylpiperazinones by reacting an alkylene oxide with decahydropyrazino[2,3-b]pyrazine or its substituted derivatives THE DOW CHEMICAL COMPANY (US) 1989-03-21 US disclosed
US-4814447-A Preparation of hydroxyalkylpiperazinones by reacting an alkylene oxide with decahydropyrazino[2,3-b]pyrazine or its substituted derivatives THE DOW CHEMICAL COMPANY (US) 1989-03-21 US disclosed
US-4443602-A EXPLOSIVES, PROPELLANTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1984-04-17 US disclosed
US-4443602-A EXPLOSIVES, PROPELLANTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1984-04-17 US disclosed
US-4374947-A COPPER SALTS AMERICAN CYANAMID COMPANY (US) 1983-02-22 US disclosed
US-4218559-A FUSED PYRAZINE COMPOUNDS AMERICAN CYANAMID COMPANY (US) 1980-08-19 US disclosed