⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL713880 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL2384104 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL5898707 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL820142 | 0.76 | ATM (0.32) | — | |
| Hydrochloric Acid SCHEMBL715438 | 0.76 | RXRA (0.32) | — | |
| Hydrochloric Acid SCHEMBL714698 | 0.76 | MDM2 (0.30) | — | |
| SCHEMBL27517839 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL720099 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL715142 | 0.74 | — | — | |
| SCHEMBL5620183 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20100063228-A1 | TRANSITION METAL COMPLEX, PROCESS FOR PRODUCING THE SAME, AND USE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-03-11 | — | — | US | disclosed |