⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9233589 | 0.85 | — | — | |
| SCHEMBL27448305 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL7771975 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL7772011 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL7772102 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL7774268 | 0.77 | — | — | |
| SCHEMBL27429104 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL7772214 | 0.71 | — | — | |
| SCHEMBL27365293 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL7772292 | 0.69 | — | — |
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-0719803-A2 | Process for the production of cycloolefin random copolymer | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1996-07-03 | — | — | EP | disclosed |