⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27891696 | 0.89 | — | — | |
| SCHEMBL1534651 | 0.87 | — | — | |
| SCHEMBL5889355 | 0.87 | — | — | |
| SCHEMBL8995974 | 0.87 | — | — | |
| SCHEMBL28997353 | 0.75 | — | — | |
| SCHEMBL20377420 | 0.75 | — | — | |
| SCHEMBL28710195 | 0.75 | — | — | |
| SCHEMBL5988045 | 0.75 | — | — | |
| SCHEMBL28615451 | 0.75 | — | — | |
| SCHEMBL31419317 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102941099-A | Lanthanum calcium iron cobalt calcium titanium ore type catalyst for oxidizing and reforming ethanol and method for preparing catalyst | UNIV TIANJIN | 2013-02-27 | — | — | CN | claimed |
| CN-102941099-A | Lanthanum calcium iron cobalt calcium titanium ore type catalyst for oxidizing and reforming ethanol and method for preparing catalyst | UNIV TIANJIN | 2013-02-27 | — | — | CN | disclosed |