⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6176548 | 0.74 | MAPT (0.31) | — | |
| SCHEMBL31476736 | 0.73 | — | — | |
| SCHEMBL3316757 | 0.72 | — | — | |
| SCHEMBL11154550 | 0.70 | — | — | |
| SCHEMBL17239068 | 0.70 | — | — | |
| SCHEMBL1275945 | 0.70 | — | — | |
| SCHEMBL3749284 | 0.70 | — | — | |
| SCHEMBL10383716 | 0.70 | — | — | |
| SCHEMBL27665 | 0.70 | — | — | |
| SCHEMBL23220496 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0864606-B1 | RUBBER COMPOSITION | ZEON CORP (JP) | 2002-06-05 | — | — | EP | disclosed |
| US-6333375-B1 | DIENE RUBBER WITH SILICA AND CARBON BLACK FOR WEAR RESISTANT COATINGS | ZEON CORPORATION (JP) | 2001-12-25 | — | — | US | disclosed |