⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL321042 | 0.67 | LMNA (0.33) | — | |
| SCHEMBL2160280 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL3586574 | 0.65 | LMNA (0.31) | — | |
| SCHEMBL21184390 | 0.62 | — | — | |
| SCHEMBL19547612 | 0.62 | — | — | |
| SCHEMBL22050834 | 0.61 | TDP1 (0.35) | — | |
| SCHEMBL7141286 | 0.61 | ALDH1A1 (0.35) | — | |
| SCHEMBL1951014 | 0.61 | ALDH1A1 (0.35) | — | |
| SCHEMBL11371340 | 0.59 | ALDH1A1 (0.33) | — | |
| SCHEMBL50594 | 0.59 | CHRM2 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023067111-A1 | METHOD FOR PRODUCING SELF-HEALING ORGANIC-INORGANIC MATERIALS | ASOCIACIÓN CENTRO DE INVESTIGACIÓN COOPERATIVA EN NANOCIENCIAS "CIC nanoGUNE" (ES) | 2023-04-27 | — | — | WO | disclosed |
| EP-3827111-A1 | METHOD FOR PRODUCING ORGANIC-INORGANIC HYBRID MATERIALS | CIC nanoGUNE - Asociación Centro de Investigación Cooperativa en Nanociencias (ES) | 2021-06-02 | — | — | EP | disclosed |
| WO-2020020972-A1 | METHOD FOR PRODUCING ORGANIC-INORGANIC HYBRID MATERIALS | CIC NANOGUNE - ASOCIACIÓN CENTRO DE INVESTIGACIÓN COOPERATIVA EN NANOCIENCIAS (ES) | 2020-01-30 | — | — | WO | disclosed |