⚠ 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 | |
|---|---|---|---|---|
| Propane SCHEMBL7198921 | 0.79 | — | — | |
| Propane SCHEMBL17460062 | 0.79 | ALDH1A1 (0.40) | — | |
| Propane SCHEMBL7199013 | 0.79 | — | — | |
| Propane SCHEMBL8755715 | 0.79 | — | — | |
| Propane SCHEMBL272919 | 0.79 | — | — | |
| Propane SCHEMBL7197523 | 0.79 | — | — | |
| Propane SCHEMBL7203579 | 0.79 | — | — | |
| Ethane SCHEMBL5235299 | 0.72 | — | — | |
| Propane SCHEMBL4349398 | 0.72 | — | — | |
| Propane SCHEMBL30443431 | 0.72 | ALDH1A1 (0.36) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5770663-A | HOMO OR COPOLYMERIZING UNSATURATED MONOMER SELECTED FROM ALPHA-OLEFIN IN PRESENCE OF METALLOCENE CATALYST AND A ORGANOMETALLIC COMPOUND OF 1A, 2A AND 3B AS COCATALYST | PHILLIPS PETROLEUM COMPANY (US) | 1998-06-23 | — | — | US | claimed |
| CN-1068829-A | Organometallic fluorenyl compounds and preparation thereof and application | PHILLIPS PETROLEUM CO (US) | 1993-02-10 | — | — | CN | claimed |
| US-6403734-B1 | POLYMERIZING ALPHA-OLEFIN BY CONTACTING WITH CATALYST SYSTEM COMPRISING BRIDGED FLUORENYL METALLOCENE CONTAINING METAL OF GROUP 4 OR 5 AND SUITABLE COCATALYST | PHILLIPS PETROLEUM COMPANY | 2002-06-11 | — | — | US | disclosed |
| EP-1169367-A1 | POLYMERISATION OF ETHYLENE | ATOFINA Research (BE) | 2002-01-09 | — | — | EP | disclosed |
| WO-2000058381-A1 | POLYMERISATION OF ETHYLENE | ATOFINA RESEARCH (BE) | 2000-10-05 | — | — | WO | disclosed |
| CN-1170002-A | Processes to produce-aluminoxane compositions | PHILLIPS PETROLEUM CO (US) | 1998-01-14 | — | — | CN | disclosed |
| CN-1068829-A | Organometallic fluorenyl compounds and preparation thereof and application | PHILLIPS PETROLEUM CO (US) | 1993-02-10 | — | — | CN | disclosed |