⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5405967 | 0.93 | — | — | |
| SCHEMBL8056539 | 0.93 | — | — | |
| Bromide SCHEMBL8050751 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL3516912 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL2353719 | 0.86 | — | — | |
| Fluoride SCHEMBL1569430 | 0.76 | — | — | |
| Carbon Monoxide SCHEMBL11241006 | 0.76 | — | — | |
| Fluoride SCHEMBL8050609 | 0.76 | — | — | |
| Propane SCHEMBL11764249 | 0.68 | TSHR (0.38) | — | |
| Propane SCHEMBL787113 | 0.68 | TSHR (0.38) | — |
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-6114496-A | Biodegradable resin composition and preparation process thereof | NISHIKAWA RUBBER CO., LTD. (JP) | 2000-09-05 | — | — | US | disclosed |