⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL152163 | 0.78 | LTA4H (0.32) | — | |
| SCHEMBL329137 | 0.78 | — | — | |
| SCHEMBL7100899 | 0.74 | — | — | |
| SCHEMBL9980586 | 0.74 | — | — | |
| SCHEMBL446263 | 0.74 | — | — | |
| SCHEMBL971622 | 0.74 | — | — | |
| SCHEMBL1404380 | 0.74 | — | — | |
| SCHEMBL7763042 | 0.74 | — | — | |
| SCHEMBL10395477 | 0.74 | ALDH1A1 (0.42) | — | |
| SCHEMBL5591624 | 0.74 | — | — |
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-111269424-A | Polysiloxane compound, preparation method and application thereof | 北京化工大学 | 2020-06-12 | — | — | CN | claimed |
| US-20040121941-A1 | Novel inhibitors of prenylated pyrophosphate consuming enzymes | RIJKSUNIVERSITEIT LEIDEN (NL) | 2004-06-24 | — | — | US | claimed |
| US-6624147-B1 | Inhibiting protein:prenyl transferases, such as protein:geranylgeranyl transferase-1, and other prenyl pyrophosphate-consuming enzymes such as squalene synthase and geranylgeranyl pyrophosphate synthase are disclosed. | RIJKSUNIVERSITEIT LEIDEN (NL) | 2003-09-23 | — | — | US | claimed |
| EP-1090909-A1 | Novel inhibitors of prenylated pyrophosphate consuming enzymes | RIJKSUNIVERSITEIT LEIDEN (NL) | 2001-04-11 | — | — | EP | claimed |
| CN-111269424-A | Polysiloxane compound, preparation method and application thereof | 北京化工大学 | 2020-06-12 | — | — | CN | disclosed |
| US-20040121941-A1 | Novel inhibitors of prenylated pyrophosphate consuming enzymes | RIJKSUNIVERSITEIT LEIDEN (NL) | 2004-06-24 | — | — | US | disclosed |