⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9722061 | 0.80 | — | — | |
| SCHEMBL9318072 | 0.75 | — | — | |
| SCHEMBL10613859 | 0.74 | — | — | |
| SCHEMBL7120876 | 0.73 | — | — | |
| SCHEMBL15254049 | 0.72 | — | — | |
| SCHEMBL10953809 | 0.72 | TSHR (0.39) | — | |
| SCHEMBL9773339 | 0.70 | TSHR (0.33) | — | |
| SCHEMBL6537476 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL7930116 | 0.70 | — | — | |
| SCHEMBL30545574 | 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 |
|---|---|---|---|---|---|---|---|
| US-H1388-H | Metathesis polymerizable olefin monomer, procatalyst, procatalyst activator, and at least one of lewis acid catlayst , anionic catalyst, free radical initiator and hydrosilation catalyst | HERCULES INCORPORATED (US) | 1994-12-06 | — | — | US | claimed |
| US-4933402-A | Phosphorus compounds that delay the metathesis polymerization of cycloolefins | HERCULES INCORPORATED (US) | 1990-06-12 | — | — | US | claimed |