⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13886363 | 0.73 | — | — | |
| SCHEMBL9249936 | 0.69 | — | — | |
| SCHEMBL7826296 | 0.69 | TRPA1 (0.37) | — | |
| SCHEMBL314782 | 0.67 | — | — | |
| SCHEMBL477823 | 0.67 | — | — | |
| SCHEMBL18718161 | 0.65 | — | — | |
| SCHEMBL3714708 | 0.65 | — | — | |
| SCHEMBL10690402 | 0.65 | — | — | |
| SCHEMBL949685 | 0.65 | — | — | |
| SCHEMBL13842047 | 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 |
|---|---|---|---|---|---|---|---|
| EP-0808840-B1 | Process for preparing tribromoneopentyl chloroalkyl phosphates | DAIHACHI CHEM IND (JP) | 2002-02-06 | — | — | EP | claimed |