⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL983496 | 0.70 | — | — | |
| SCHEMBL4269064 | 0.67 | — | — | |
| SCHEMBL6573284 | 0.67 | — | — | |
| Formaldehyde SCHEMBL8899421 | 0.64 | TRPA1 (0.31) | — | |
| SCHEMBL27406115 | 0.64 | — | — | |
| SCHEMBL584171 | 0.61 | — | — | |
| SCHEMBL4725494 | 0.58 | — | — | |
| SCHEMBL11804916 | 0.58 | — | — | |
| SCHEMBL11769333 | 0.58 | — | — | |
| SCHEMBL11804910 | 0.58 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115970757-B | Non-metallocene rare earth metal hydrocarbon functionalization reaction catalyst, preparation method and application thereof | 四川大学 | 2024-07-09 | — | — | CN | disclosed |
| EP-2170258-A2 | ORGANOPOLYSILOXANE | Kao Corporation (JP) | 2010-04-07 | — | — | EP | disclosed |
| WO-2009014237-A2 | ORGANOPOLYSILOXANE | KAO CORPORATION (JP) | 2009-01-29 | — | — | WO | disclosed |