⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19307312 | 0.77 | — | — | |
| SCHEMBL7947236 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL450621 | 0.71 | — | — | |
| SCHEMBL17698564 | 0.71 | — | — | |
| SCHEMBL19022476 | 0.67 | — | — | |
| Biphenyl SCHEMBL28770505 | 0.66 | ALDH1A1 (0.41) | — | |
| SCHEMBL17698608 | 0.66 | — | — | |
| SCHEMBL4557940 | 0.65 | NPC1 (0.44) | — | |
| Hydrochloric Acid SCHEMBL450843 | 0.65 | — | — | |
| SCHEMBL6238288 | 0.65 | NPC1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0709405-B1 | Process for the production of olefin polymers | TOSOH CORP (JP) | 2001-05-02 | — | — | EP | disclosed |
| EP-0709405-A1 | Process for the production of olefin polymers | Tosoh Corporation (JP) | 1996-05-01 | — | — | EP | disclosed |