⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL909812 | 0.70 | CHRNA7 (0.33) | — | |
| SCHEMBL1170017 | 0.64 | CACNA1D (0.31) | — | |
| SCHEMBL8736494 | 0.60 | KDM1A (0.33) | — | |
| SCHEMBL3780105 | 0.60 | MAPT (0.33) | — | |
| SCHEMBL2390258 | 0.57 | HTR2C (0.32) | — | |
| SCHEMBL222998 | 0.57 | CHRNA7 (0.35) | — | |
| SCHEMBL7427186 | 0.55 | KDM1A (0.39) | — | |
| Hydrogen Sulfide SCHEMBL8857190 | 0.55 | CHRNA7 (0.34) | — | |
| SCHEMBL909125 | 0.54 | CHRNA7 (0.33) | — | |
| SCHEMBL5390121 | 0.54 | CHRNA7 (0.33) | — |
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-20220030862-A1 | SYNERGISTIC PRESERVATIVE COMPOSITIONS, PROCESS FOR PREPARING THE SAME AND METHOD OF USE THEREOF | ISP INVESTMENTS LLC (US) | 2022-02-03 | — | — | US | disclosed |
| EP-3886582-A1 | SYNERGISTIC PRESERVATIVE COMPOSITIONS, PROCESS FOR PREPARING THE SAME AND METHOD OF USE THEREOF | ISP Investments LLC (US) | 2021-10-06 | — | — | EP | disclosed |
| WO-2020113211-A1 | SYNERGISTIC PRESERVATIVE COMPOSITIONS, PROCESS FOR PREPARING THE SAME AND METHOD OF USE THEREOF | ISP INVESTMENTS LLC (US) | 2020-06-04 | — | — | WO | disclosed |