⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30968750 | 0.81 | — | — | |
| SCHEMBL544078 | 0.81 | — | — | |
| SCHEMBL2643257 | 0.71 | — | — | |
| SCHEMBL366126 | 0.71 | — | — | |
| SCHEMBL5845803 | 0.71 | — | — | |
| SCHEMBL27712 | 0.71 | — | — | |
| SCHEMBL8810777 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL27899668 | 0.70 | — | — | |
| SCHEMBL130185 | 0.70 | — | — | |
| SCHEMBL27386848 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0773930-A1 | AROMATIC AMINO ETHERS AS PAIN RELIEVING AGENTS | ZENECA LIMITED (GB) | 1997-05-21 | — | — | EP | claimed |
| WO-2002043680-A1 | FIXATION OF CARBOHYDRATES TO FIBROUS MATERIALS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2002-06-06 | — | — | WO | disclosed |
| WO-2002043678-A2 | ENZYMATIC FIXATION OF DERIVATISED CARBOHYDRATES TO FIBROUS MATERIALS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2002-06-06 | — | — | WO | disclosed |
| EP-0773930-A1 | AROMATIC AMINO ETHERS AS PAIN RELIEVING AGENTS | ZENECA LIMITED (GB) | 1997-05-21 | — | — | EP | disclosed |