⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL173415 | 0.97 | — | — | |
| SCHEMBL29083648 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL6247558 | 0.95 | — | — | |
| SCHEMBL29083659 | 0.95 | — | — | |
| Bromide SCHEMBL28355066 | 0.95 | — | — | |
| SCHEMBL28775118 | 0.95 | — | — | |
| SCHEMBL27940374 | 0.95 | — | — | |
| SCHEMBL27543323 | 0.95 | — | — | |
| Formic Acid SCHEMBL29128942 | 0.89 | ALDH1A1 (0.41) | — | |
| Acrylic Acid SCHEMBL29279403 | 0.85 | LMNA (0.40) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9878906-B2 | Method for producing organometallic framework materials containing main group metal ions | BASF SE (DE) | 2018-01-30 | — | — | US | disclosed |
| EP-1922299-B1 | METHOD FOR PRODUCING ORGANOMETALLIC FRAMEWORK MATERIALS CONTAINING MAIN GROUP METAL IONS | BASF SE (DE) | 2010-11-24 | — | — | EP | disclosed |
| US-20100166644-A1 | METHOD FOR PRODUCING ORGANOMETALLIC FRAMEWORK MATERIALS CONTAINING MAIN GROUP METAL IONS | BASF SE (DE) | 2010-07-01 | — | — | US | disclosed |
| EP-1922299-A1 | METHOD FOR PRODUCING ORGANOMETALLIC FRAMEWORK MATERIALS CONTAINING MAIN GROUP METAL IONS | BASF SE (DE) | 2008-05-21 | — | — | EP | disclosed |
| WO-2007023134-A1 | METHOD FOR PRODUCING ORGANOMETALLIC FRAMEWORK MATERIALS CONTAINING MAIN GROUP METAL IONS | BASF AKTIENGESELLSCHAFT (DE) | 2007-03-01 | — | — | WO | disclosed |