⚠ 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 | |
|---|---|---|---|---|
| Silicate SCHEMBL11693172 | 1.00 | — | — | |
| Silicate SCHEMBL11525735 | 0.95 | — | — | |
| Formaldehyde SCHEMBL107105 | 0.91 | — | — | |
| Formaldehyde SCHEMBL10901263 | 0.88 | — | — | |
| Acrolein SCHEMBL11602892 | 0.86 | — | — | |
| Urea SCHEMBL9073316 | 0.86 | ALDH1A1 (0.30) | — | |
| Formaldehyde SCHEMBL8069857 | 0.86 | — | — | |
| Ethylene SCHEMBL5493599 | 0.83 | — | — | |
| SCHEMBL13621673 | 0.83 | — | — | |
| Water SCHEMBL2152723 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4169930-A | PROCESS FOR THE PRODUCTION OF AMINO SILICATE COMPOUNDS AND THEIR CONDENSATION PRODUCTS | BLOUNT DAVID H | 1979-10-02 | — | — | US | disclosed |
| US-4096118-A | Process for the production of amino silicate compounds and their resinous products | BLOUNT DAVID H | 1978-06-20 | — | — | US | disclosed |
| US-4033935-A | Process for the production of amino silicate compounds and their condensation products | BLOUNT DAVID H | 1977-07-05 | — | — | US | disclosed |