⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7047537 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL9011523 | 0.76 | — | — | |
| SCHEMBL6220747 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL8462322 | 0.72 | — | — | |
| SCHEMBL9011534 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL8465512 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL6568510 | 0.69 | — | — | |
| SCHEMBL8150380 | 0.68 | — | — | |
| SCHEMBL7052914 | 0.66 | — | — | |
| SCHEMBL7052687 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6084043-A | BRIDGED FUSED CYCLOPENTADIENE RINGS SUCH AS HEXAHYDROAZULENE WITH GIVEN SUBSTITUENTS DERIVATIVES WITH A GROUP 4B TRANSITION METAL; PRODUCES ALPHA-OLEFIN POLYMERS HAVING HIGH MELTING POINT AND HIGH MOLECULAR WEIGHT IN A HIGH YIELD | MITSUBISHI CHEMICAL CORPORATION (JP) | 2000-07-04 | — | — | US | disclosed |
| EP-0697418-B1 | Catalyst component for polymerization of alpha-olefins and process for producing alpha-olefin polymers using the same | MITSUBISHI CHEM CORP (JP) | 1998-05-06 | — | — | EP | disclosed |
| EP-0697418-A1 | Catalyst component for polymerization of alpha-olefins and process for producing alpha-olefin polymers using the same | MITSUBISHI CHEMICAL CORPORATION (JP) | 1996-02-21 | — | — | EP | disclosed |