⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8831747 | 0.97 | — | — | |
| SCHEMBL23802737 | 0.94 | ITGB3 (0.50) | — | |
| SCHEMBL23802787 | 0.94 | ITGB3 (0.50) | — | |
| SCHEMBL25154745 | 0.82 | ITGB3 (0.41) | — | |
| SCHEMBL25154474 | 0.82 | ITGB3 (0.41) | — | |
| SCHEMBL27909011 | 0.82 | SLC6A1 (0.48) | — | |
| SCHEMBL25154377 | 0.82 | ITGB3 (0.41) | — | |
| SCHEMBL30655974 | 0.82 | ITGB3 (0.41) | — | |
| SCHEMBL2869452 | 0.80 | — | — | |
| SCHEMBL21315847 | 0.79 | SLC6A1 (0.50) | — |
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-109876600-A | The removing method and sour gas removing device of acid gas absorbent, sour gas | 株式会社东芝 | 2019-06-14 | — | — | CN | claimed |
| CN-109876600-A | The removing method and sour gas removing device of acid gas absorbent, sour gas | 株式会社东芝 | 2019-06-14 | — | — | CN | disclosed |