⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10705378 | 0.81 | LDHA (0.38) | — | |
| SCHEMBL11791590 | 0.75 | — | — | |
| SCHEMBL9560314 | 0.75 | — | — | |
| Ammonia Solution, Strong SCHEMBL28082756 | 0.73 | LDHA (0.47) | — | |
| SCHEMBL2791142 | 0.71 | — | — | |
| SCHEMBL292267 | 0.69 | — | — | |
| SCHEMBL188356 | 0.69 | — | — | |
| SCHEMBL5683618 | 0.67 | — | — | |
| Benzene SCHEMBL28141565 | 0.67 | ACHE (0.43) | — | |
| SCHEMBL285654 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0733940-A1 | Reduction of spot image defects caused by metal impurities in photographic film | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1996-09-25 | — | — | EP | disclosed |