⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL302281 | 0.82 | — | — | |
| SCHEMBL29357530 | 0.82 | — | — | |
| SCHEMBL462701 | 0.82 | — | — | |
| SCHEMBL17137871 | 0.67 | — | — | |
| SCHEMBL15253544 | 0.67 | — | — | |
| SCHEMBL1717321 | 0.67 | — | — | |
| SCHEMBL10536686 | 0.67 | — | — | |
| Lithium Ion SCHEMBL31042496 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL2296766 | 0.67 | — | — | |
| SCHEMBL15350148 | 0.67 | — | — |
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-7087551-B2 | Catalyst for use in catalytic oxidation or ammoxidation of propane or isobutane in the gaseous phase | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2006-08-08 | — | — | US | disclosed |
| CN-1419473-A | Catalyst for vapor-phase catalytic oxidation or vapor-phase catalytic ammoxidation of propane or isobutane | ASAHI CHEMICAL IND (JP) | 2003-05-21 | — | — | CN | disclosed |
| US-20030088118-A1 | Catalyst for use in catalytic oxidation or ammoxidation of propane or isobutane in the gaseous phase | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2003-05-08 | — | — | US | disclosed |