⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15592381 | 0.80 | — | — | |
| SCHEMBL887651 | 0.78 | ALDH1A1 (0.40) | — | |
| Magnesium SCHEMBL10632211 | 0.76 | ALDH1A1 (0.39) | — | |
| SCHEMBL19155881 | 0.76 | — | — | |
| SCHEMBL10642096 | 0.76 | — | — | |
| SCHEMBL27674292 | 0.75 | LMNA (0.44) | — | |
| SCHEMBL19060744 | 0.74 | ALDH1A1 (0.37) | — | |
| SCHEMBL15628632 | 0.74 | — | — | |
| SCHEMBL31197929 | 0.74 | — | — | |
| SCHEMBL15297095 | 0.74 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070072285-A1 | Fluid interface for bioprocessor systems | GROTON BIOSYSTEMS, LLC | 2007-03-29 | — | — | US | disclosed |