⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7253053 | 0.84 | ALDH1A1 (0.35) | — | |
| SCHEMBL43616 | 0.84 | — | — | |
| SCHEMBL29755807 | 0.81 | — | — | |
| Ammonia Solution, Strong SCHEMBL29259639 | 0.81 | — | — | |
| Ammonia Solution, Strong SCHEMBL30475697 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL29259729 | 0.77 | — | — | |
| Bromide SCHEMBL29259354 | 0.77 | — | — | |
| SCHEMBL3686514 | 0.72 | — | — | |
| 1,1,2,2-Tetrachloroethane SCHEMBL17844299 | 0.71 | TDP1 (0.36) | — | |
| SCHEMBL8322674 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5919984-A | Catalytic process for the selective oxidation of organic tertiary polyphosphines to phosphine monooxides | GRUSHIN VLADIMIR (US) | 1999-07-06 | — | — | US | claimed |
| US-5919984-A | Catalytic process for the selective oxidation of organic tertiary polyphosphines to phosphine monooxides | GRUSHIN VLADIMIR (US) | 1999-07-06 | — | — | US | disclosed |