Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL350615 | 0.72 | POLB (0.37) | — | |
| Hydrochloric Acid SCHEMBL3717728 | 0.71 | CHRM5 (0.38) | — | |
| Bromide SCHEMBL28351059 | 0.71 | GALR3 (0.38) | — | |
| SCHEMBL16594404 | 0.70 | BBOX1 (0.38) | — | |
| SCHEMBL2470945 | 0.69 | TSHR (0.44) | — | |
| SCHEMBL28881714 | 0.68 | RECQL (0.41) | — | |
| SCHEMBL29290535 | 0.68 | BBOX1 (0.35) | — | |
| Sulfuric Acid SCHEMBL15361643 | 0.68 | BBOX1 (0.35) | — | |
| SCHEMBL27780849 | 0.67 | RECQL (0.44) | — | |
| SCHEMBL7688089 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001030128-A1 | SOIL SEQUESTERING ARTICLE | THE DOW CHEMICAL COMPANY (US) | 2001-05-03 | — | — | WO | disclosed |