⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5693430 | 0.78 | — | — | |
| SCHEMBL22646537 | 0.77 | — | — | |
| SCHEMBL9814623 | 0.77 | NFKB1 (0.30) | — | |
| SCHEMBL9814664 | 0.77 | MEN1 (0.32) | — | |
| SCHEMBL3279366 | 0.76 | KDM4E (0.32) | — | |
| SCHEMBL28690185 | 0.76 | CCR2 (0.33) | — | |
| SCHEMBL5693453 | 0.75 | PAOX (0.35) | — | |
| Ethylamine SCHEMBL11145007 | 0.75 | GRIK1 (0.41) | — | |
| SCHEMBL11760961 | 0.75 | — | — | |
| SCHEMBL2350820 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0882738-B1 | DIENE RUBBER, PROCESS FOR PRODUCING THE RUBBER AND RUBBER COMPOSITION CONTAINING THE SAME | ZEON CORP (JP) | 2002-11-20 | — | — | EP | disclosed |
| US-6147178-A | RUBBER COMPRISING DIENE-VINYL AROMATIC COPOLYMER BEARING QUATERNARY AMMONIUM GROUPS; TENSILE STRENGTH, WEAR RESISTANCE, HEAT RESISTANCE, IMPROVED AFFINITY FOR SILICA REINFORCEMENT | NIPPON ZEON CO., LTD. (JP) | 2000-11-14 | — | — | US | disclosed |
| EP-0882738-A1 | DIENE RUBBER, PROCESS FOR PRODUCING THE RUBBER AND RUBBER COMPOSITION CONTAINING THE SAME | NIPPON ZEON CO., LTD. (JP) | 1998-12-09 | — | — | EP | disclosed |