⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10577984 | 0.87 | — | — | |
| SCHEMBL2563930 | 0.83 | LCK (0.32) | — | |
| SCHEMBL30678313 | 0.83 | LCK (0.32) | — | |
| SCHEMBL20494563 | 0.83 | LCK (0.32) | — | |
| SCHEMBL2566428 | 0.83 | LCK (0.32) | — | |
| SCHEMBL2567606 | 0.79 | — | — | |
| SCHEMBL28425691 | 0.79 | — | — | |
| SCHEMBL19783669 | 0.77 | TSHR (0.41) | — | |
| SCHEMBL6510173 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL1849901 | 0.73 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7462752-B2 | Process to convert linear alkanes into alpha olefins | SHELL OIL COMPANY (US) | 2008-12-09 | — | — | US | disclosed |
| US-7091387-B2 | Process to convert alkanes into primary alcohols | SHELL OIL COMPANY (US) | 2006-08-15 | — | — | US | disclosed |
| WO-2005110953-A1 | DERIVATIVES OF ALCOHOLS AND OLEFINS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2005-11-24 | — | — | WO | disclosed |
| WO-2005105715-A1 | PROCESS TO CONVERT ALKANES INTO PRIMARY ALCOHOLS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2005-11-10 | — | — | WO | disclosed |
| WO-2005105709-A1 | PROCESS TO CONVERT LINEAR ALKANES INTO ALPHA OLEFINS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2005-11-10 | — | — | WO | disclosed |
| US-20050245772-A1 | Derivatives of alcohols and olefins | SHELL OIL COMPANY | 2005-11-03 | — | — | US | disclosed |
| US-20050245777-A1 | Process to convert linear alkanes into alpha olefins | SHELL OIL COMPANY | 2005-11-03 | — | — | US | disclosed |
| US-20050245771-A1 | Process to convert alkanes into primary alcohols | SHELL OIL COMPANY | 2005-11-03 | — | — | US | disclosed |