⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28279270 | 0.93 | — | — | |
| SCHEMBL28330157 | 0.91 | — | — | |
| SCHEMBL28840510 | 0.91 | — | — | |
| SCHEMBL781155 | 0.91 | — | — | |
| SCHEMBL662643 | 0.91 | — | — | |
| SCHEMBL28237211 | 0.91 | — | — | |
| SCHEMBL25988 | 0.91 | — | — | |
| SCHEMBL11080862 | 0.91 | — | — | |
| Water SCHEMBL25316652 | 0.83 | — | — | |
| SCHEMBL9842262 | 0.83 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104528746-B | A kind of preparation method of crystallite pollucite | 西南科技大学 | 2016-07-06 | — | — | CN | claimed |
| CN-104528746-A | Preparation method of microcrystalline pollucite | UNIV SW SCI & TECH SWUST | 2015-04-22 | — | — | CN | claimed |
| CN-104528746-B | A kind of preparation method of crystallite pollucite | 西南科技大学 | 2016-07-06 | — | — | CN | disclosed |
| CN-104528746-B | A kind of preparation method of crystallite pollucite | 西南科技大学 | 2016-07-06 | — | — | CN | disclosed |
| CN-104528746-A | Preparation method of microcrystalline pollucite | UNIV SW SCI & TECH SWUST | 2015-04-22 | — | — | CN | disclosed |
| CN-104528746-A | Preparation method of microcrystalline pollucite | UNIV SW SCI & TECH SWUST | 2015-04-22 | — | — | CN | disclosed |