⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8171029 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL179970 | 0.76 | — | — | |
| SCHEMBL2759401 | 0.73 | — | — | |
| SCHEMBL9371845 | 0.72 | — | — | |
| SCHEMBL1566995 | 0.72 | — | — | |
| SCHEMBL14645497 | 0.71 | — | — | |
| Ethylene Glycol SCHEMBL11369374 | 0.71 | — | — | |
| SCHEMBL11221488 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL8067098 | 0.69 | — | — | |
| SCHEMBL10906816 | 0.69 | — | — |
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-4686757-A1 | INHIBITORS OF EXPRESSION AND/OR FUNCTION | e-therapeutics PLC (GB) | 2026-02-04 | — | — | EP | disclosed |
| WO-2011028574-A1 | FLAME RETARDANT ADDITIVE COMPOSITION AND POLYURETHANE FOAM-FORMING COMPOSITION AND POLYURETHANE FOAM CONTAINING SAME | ICL-IP AMERICA INC. (US) | 2011-03-10 | — | — | WO | disclosed |