SCHEMBL2481392

SCHEMBL2481392

[Al+3].[Al+3].[C-]#[C-].[C-]#[C-].[C-]#[C-]

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
Lithium Ion SCHEMBL11857677 0.87
Lithium Ion SCHEMBL263443 0.67
SCHEMBL2892165 0.67
SCHEMBL38137 0.67
Silver SCHEMBL663456 0.67
SCHEMBL7714931 0.67
SCHEMBL5878685 0.67
SCHEMBL3896298 0.67
SCHEMBL3316570 0.67
SCHEMBL5878586 0.67

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-8703792-B2 C-1 analogs of pancratistatin and 7-deoxypancratistatin and processes for their preparation BROCK UNIVERSITY (CA) 2014-04-22 US claimed
EP-2376498-A1 NOVEL C-1ANALOGS OF PANCRATISTATIN AND 7-DEOXYPANCRATISTATIN AND PROCESSES FOR THEIR PREPARATION Brock University (CA) 2011-10-19 EP claimed
WO-2010069054-A1 NOVEL C-1ANALOGS OF PANCRATISTATIN AND 7-DEOXYPANCRATISTATIN AND PROCESSES FOR THEIR PREPARATION BROCK UNIVERSITY (CA) 2010-06-24 WO claimed
US-11780791-B2 (6Z,9Z)-6,9-dodecadien-1-yne and a process for preparing the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-10-10 US disclosed
US-20220332667-A1 (6Z,9Z)-6,9-DODECADIEN-1-YNE AND A PROCESS FOR PREPARING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-10-20 US disclosed
US-8703792-B2 C-1 analogs of pancratistatin and 7-deoxypancratistatin and processes for their preparation BROCK UNIVERSITY (CA) 2014-04-22 US disclosed
EP-2376498-A1 NOVEL C-1ANALOGS OF PANCRATISTATIN AND 7-DEOXYPANCRATISTATIN AND PROCESSES FOR THEIR PREPARATION Brock University (CA) 2011-10-19 EP disclosed
WO-2010069054-A1 NOVEL C-1ANALOGS OF PANCRATISTATIN AND 7-DEOXYPANCRATISTATIN AND PROCESSES FOR THEIR PREPARATION BROCK UNIVERSITY (CA) 2010-06-24 WO disclosed
EP-0799183-A4 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-ONE MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORP (US) 1998-03-25 EP disclosed
EP-0799182-A4 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-OL DIMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORP (US) 1998-03-25 EP disclosed
EP-0796091-A4 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-OL MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORP (US) 1998-03-25 EP disclosed
EP-0796091-A1 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-OL MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1997-09-24 EP disclosed
EP-0796092-A1 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-ONE DIMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1997-09-24 EP disclosed
WO-1996020690-A2 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-YLIDINE ACETATE MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-07-11 WO disclosed
WO-1996019977-A1 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-OL MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-07-04 WO disclosed
WO-1996020159-A1 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-YLIDINE ACETATE MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-07-04 WO disclosed
WO-1996020157-A1 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-OL DIMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-07-04 WO disclosed
WO-1996019980-A1 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-ONE DIMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-07-04 WO disclosed
WO-1996020158-A1 3,3-(DISUBSTITUTED)CYCLOHEXAN-1-ONE MONOMERS AND RELATED COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1996-07-04 WO disclosed
US-4309351-A INTERMEDIATES FOR PROSTAGLANDIN-LIKE COMPOUNDS THE UNIVERSITY OF CHICAGO (US) 1982-01-05 US disclosed