⚠ 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 SCHEMBL6469675 | 0.74 | — | — | |
| SCHEMBL8162371 | 0.69 | — | — | |
| SCHEMBL409596 | 0.69 | — | — | |
| SCHEMBL216231 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL9357195 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL966885 | 0.69 | — | — | |
| SCHEMBL6652777 | 0.67 | — | — | |
| SCHEMBL9705999 | 0.67 | — | — | |
| SCHEMBL1305709 | 0.67 | — | — | |
| SCHEMBL7263423 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7989323-B2 | Doping method | ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) | 2011-08-02 | — | — | US | disclosed |
| US-20110003463-A1 | DOPING METHOD | ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) | 2011-01-06 | — | — | US | disclosed |