⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1579734 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL18726122 | 0.89 | TDP1 (0.52) | — | |
| SCHEMBL687260 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL519119 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL17074780 | 0.77 | — | — | |
| SCHEMBL756103 | 0.77 | TDP1 (0.64) | — | |
| SCHEMBL270199 | 0.74 | — | — | |
| SCHEMBL21216 | 0.74 | ALDH1A1 (0.91) | — | |
| SCHEMBL23033217 | 0.74 | — | — | |
| SCHEMBL6747424 | 0.74 | ALDH1A1 (0.65) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170298682-A1 | INTEGRATION OF ELECTROCHROMIC FILMS ON A SUBSTRATE | LANNRAY OPTOELECTRONICS (ZHENJIANG) CO. LTD. (CN) | 2017-10-19 | — | — | US | disclosed |