⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11825144 | 0.77 | — | — | |
| SCHEMBL11033707 | 0.74 | — | — | |
| SCHEMBL30995902 | 0.64 | ALDH1A1 (0.50) | — | |
| SCHEMBL116271 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL31092070 | 0.61 | — | — | |
| SCHEMBL17077964 | 0.61 | — | — | |
| Ammonia Solution, Strong SCHEMBL21381330 | 0.61 | — | — | |
| SCHEMBL11002111 | 0.61 | — | — | |
| SCHEMBL11250233 | 0.60 | — | — | |
| SCHEMBL10968086 | 0.59 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-59225117-A | — | — | None | — | — | JP | disclosed |
| JP-59031784-A | — | — | None | — | — | JP | disclosed |
| JP-S59225117-A | ANTITUMOR AGENT | ASAI GERUMANIUMU KENKYUSHO:KK | 1984-12-18 | — | — | JP | disclosed |
| JP-S5931784-A | ORGANIC GERMANIUM COMPOUND | ASAI GERUMANIUMU KENKYUSHO:KK | 1984-02-20 | — | — | JP | disclosed |