⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8818951 | 0.89 | — | — | |
| Formaldehyde SCHEMBL13859238 | 0.86 | — | — | |
| SCHEMBL22076783 | 0.86 | — | — | |
| Methane SCHEMBL8937986 | 0.86 | — | — | |
| Ethyne SCHEMBL8937821 | 0.83 | — | — | |
| Carbon Monoxide SCHEMBL5693579 | 0.81 | — | — | |
| Carbon Monoxide SCHEMBL513145 | 0.81 | — | — | |
| Carbon Monoxide SCHEMBL8598899 | 0.81 | — | — | |
| Carbon Monoxide SCHEMBL11020911 | 0.81 | — | — | |
| SCHEMBL10610546 | 0.77 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0245061-B1 | CATALYTIC SYNTHESIS OF OLEFINS FROM PARAFFINS | ETHYL CORPORATION (US) | 1989-11-23 | — | — | EP | disclosed |
| US-4751344-A | Catalytic synthesis of olefins from paraffins | ETHYL CORPORATION (US) | 1988-06-14 | — | — | US | disclosed |
| EP-0245061-A1 | Catalytic synthesis of olefins from paraffins | ETHYL CORPORATION (US) | 1987-11-11 | — | — | EP | disclosed |
| US-4670621-A | BIS(ALKENE)CYCLOPENTADIENYL IRIDIUM COMPLEX | ETHYL CORPORATION (US) | 1987-06-02 | — | — | US | disclosed |