⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5705216 | 0.75 | MAPT (0.32) | — | |
| SCHEMBL4609643 | 0.75 | KDM4E (0.31) | — | |
| SCHEMBL30964214 | 0.75 | MAPT (0.32) | — | |
| SCHEMBL17085823 | 0.75 | — | — | |
| SCHEMBL9511066 | 0.71 | TERT (0.32) | — | |
| SCHEMBL11075642 | 0.66 | — | — | |
| Sulfuric Acid SCHEMBL2398134 | 0.66 | NT5E (0.34) | — | |
| SCHEMBL28422441 | 0.64 | — | — | |
| SCHEMBL10792756 | 0.63 | — | — | |
| SCHEMBL7051080 | 0.63 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130102049-A1 | REMOVABLE SACCHARIDE-BENZIMIDAZOLE (BIM) TAGS AND CONJUGATES THEREOF VIA 1H-POSITION OF THE BENZIMIDAZOLES | ACADEMIA SINICA (TW) | 2013-04-25 | — | — | US | claimed |
| US-9086416-B2 | Removable saccharide-benzimidazole (BIM) tags and conjugates thereof via 1H-position of the benzimidazoles | ACADEMIA SINICA (TW) | 2015-07-21 | — | — | US | disclosed |
| US-20130102049-A1 | REMOVABLE SACCHARIDE-BENZIMIDAZOLE (BIM) TAGS AND CONJUGATES THEREOF VIA 1H-POSITION OF THE BENZIMIDAZOLES | ACADEMIA SINICA (TW) | 2013-04-25 | — | — | US | disclosed |
| US-7777061-B2 | Acid-functionalized organometallic framework materials | BASF AKTIENGESELLSCHAFT (DE) | 2010-08-17 | — | — | US | disclosed |
| EP-1968746-B1 | ACID-FUNCTIONALIZED METALORGANIC FRAMEWORKS | BASF SE (DE) | 2010-08-11 | — | — | EP | disclosed |
| US-20080281116-A1 | Acid-Functionalized Organometallic Framework Materials | BASF SE (DE) | 2008-11-13 | — | — | US | disclosed |
| US-20080248944-A1 | Amine-Containing Catalyst Ink For Fuel Cells | BASF SE (DE) | 2008-10-09 | — | — | US | disclosed |
| EP-1968746-A1 | ACID-FUNCTIONALIZED ORGANOMETALLIC FRAMEWORK MATERIALS | BASF SE (DE) | 2008-09-17 | — | — | EP | disclosed |
| EP-1952473-A1 | AMINE-CONTAINING CATALYST INK FOR FUEL CELLS | BASF SE (DE) | 2008-08-06 | — | — | EP | disclosed |
| WO-2007068681-A1 | ACID-FUNCTIONALIZED ORGANOMETALLIC FRAMEWORK MATERIALS | BASF SE (DE) | 2007-06-21 | — | — | WO | disclosed |
| WO-2007054570-A1 | AMINE-CONTAINING CATALYST INK FOR FUEL CELLS | BASF SE (DE) | 2007-05-18 | — | — | WO | disclosed |
| EP-0483426-A1 | Thiol heterocyclic deodorant composition and method of deodorization | THE PROCTER & GAMBLE COMPANY (US) | 1992-05-06 | — | — | EP | disclosed |