⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7107794 | 0.86 | NPC1 (0.33) | — | |
| SCHEMBL7106984 | 0.84 | NPC1 (0.34) | — | |
| SCHEMBL7941175 | 0.79 | PNMT (0.33) | — | |
| SCHEMBL7106058 | 0.79 | NPC1 (0.32) | — | |
| SCHEMBL7934590 | 0.79 | NPC1 (0.32) | — | |
| SCHEMBL7104537 | 0.79 | NPC1 (0.32) | — | |
| SCHEMBL7101060 | 0.78 | NPC1 (0.32) | — | |
| SCHEMBL7940992 | 0.77 | PNMT (0.32) | — | |
| SCHEMBL7101948 | 0.77 | PNMT (0.32) | — | |
| SCHEMBL7103489 | 0.77 | PNMT (0.32) | — |
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-0786466-B1 | Olefin polymerisation process which comprises a transition metal catalyst. | TOSOH CORP (JP) | 2003-04-16 | — | — | EP | disclosed |
| US-6316558-B1 | POLYMERIZING OLEFIN USING CATALYST COMPRISING TRANSITION METAL COMPOUND, COMPOUND CAPABLE OF A REACTING WITH TRANSITION METAL COMPOUND TO FORM A CATIONIC TRANSITION METAL COMPOUND, ORGANOMETALLIC TO FORM POLYOLEFIN | TOSOH CORPORATION (JP) | 2001-11-13 | — | — | US | disclosed |
| EP-0786466-A1 | Transition metal compound, olefin polymerization catalyst comprising the compound, and process for production of olefin polymer | Tosoh Corporation (JP) | 1997-07-30 | — | — | EP | disclosed |