⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2927 | 1.00 | — | — | |
| Water SCHEMBL6561823 | 0.97 | INMT (0.78) | — | |
| SCHEMBL29707902 | 0.97 | INMT (0.78) | — | |
| Ammonia Solution, Strong SCHEMBL6834960 | 0.97 | INMT (0.78) | — | |
| Hydrochloric Acid SCHEMBL10432356 | 0.97 | INMT (0.78) | — | |
| Ammonia Solution, Strong SCHEMBL23880360 | 0.97 | INMT (0.78) | — | |
| SCHEMBL1812588 | 0.93 | INMT (0.72) | — | |
| SCHEMBL6211137 | 0.93 | INMT (0.95) | — | |
| SCHEMBL11028060 | 0.92 | INMT (0.78) | — | |
| SCHEMBL1696760 | 0.92 | INMT (0.95) | — |
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-2980180-A1 | PHOTOBASE GENERATOR | San-Apro Ltd. (JP) | 2016-02-03 | — | — | EP | disclosed |
| US-20160009737-A1 | PHOTOBASE GENERATOR | SAN-APRO LTD. (JP) | 2016-01-14 | — | — | US | disclosed |