⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31329278 | 0.81 | — | — | |
| SCHEMBL29980370 | 0.69 | CA1 (0.33) | — | |
| SCHEMBL2204380 | 0.69 | CA1 (0.33) | — | |
| SCHEMBL23923235 | 0.68 | — | — | |
| SCHEMBL24667270 | 0.67 | CA1 (0.32) | — | |
| SCHEMBL2204702 | 0.67 | MLYCD (0.31) | — | |
| SCHEMBL31547720 | 0.64 | — | — | |
| SCHEMBL4754969 | 0.62 | CA1 (0.37) | — | |
| SCHEMBL1008667 | 0.62 | CA1 (0.37) | — | |
| SCHEMBL11426164 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3896107-A1 | HYDROPHOBIC ACID AND BASE-RESISTANT GELS OBTAINABLE BY SILYLATION | Deutsches Zentrum für Luft- und Raumfahrt e.V. (DE) | 2021-10-20 | — | — | EP | claimed |
| EP-3896107-A1 | HYDROPHOBIC ACID AND BASE-RESISTANT GELS OBTAINABLE BY SILYLATION | Deutsches Zentrum für Luft- und Raumfahrt e.V. (DE) | 2021-10-20 | — | — | EP | disclosed |