⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL308285 | 0.82 | OPRM1 (0.33) | — | |
| SCHEMBL28102817 | 0.80 | — | — | |
| SCHEMBL28587496 | 0.80 | — | — | |
| SCHEMBL27868439 | 0.78 | — | — | |
| SCHEMBL5404768 | 0.78 | — | — | |
| SCHEMBL190614 | 0.77 | — | — | |
| SCHEMBL3823013 | 0.76 | — | — | |
| SCHEMBL1729754 | 0.76 | LMNA (0.30) | — | |
| SCHEMBL1845045 | 0.75 | — | — | |
| SCHEMBL27656994 | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6177584-B1 | Process for neutralizing and reducing residual halogen contents in alkoxysilanes or alkoxysilane-based compositions | DEGUSSA-HUELS AKTIENGESELLSCHAFT (DE) | 2001-01-23 | — | — | US | claimed |
| CN-112834088-B | Bionic MXene aerogel-based sensing material and preparation method and application thereof | 南开大学 | 2022-06-28 | — | — | CN | disclosed |
| CN-112368339-A | Additive composition, flame-retardant synthetic resin composition containing same, and molded article thereof | 株式会社ADEKA | 2021-02-12 | — | — | CN | disclosed |
| EP-0997468-B1 | Process for neutralising or reducing chlorine content of alkoxy silanes or alkoxysilane-based compositions | DEGUSSA (DE) | 2004-01-21 | — | — | EP | disclosed |
| US-6177584-B1 | Process for neutralizing and reducing residual halogen contents in alkoxysilanes or alkoxysilane-based compositions | DEGUSSA-HUELS AKTIENGESELLSCHAFT (DE) | 2001-01-23 | — | — | US | disclosed |
| EP-0997468-A2 | Process for neutralising or reducing chlorine content of alkoxy silanes or alkoxysilane-based compositions | Degussa-Hüls Aktiengesellschaft (DE) | 2000-05-03 | — | — | EP | disclosed |