⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL190278 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL11062052 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL9775717 | 0.94 | — | — | |
| SCHEMBL20985786 | 0.94 | — | — | |
| Ethane SCHEMBL28181165 | 0.94 | — | — | |
| Bromide SCHEMBL11061282 | 0.94 | — | — | |
| SCHEMBL27995798 | 0.94 | — | — | |
| SCHEMBL7739185 | 0.94 | — | — | |
| SCHEMBL2516469 | 0.75 | — | — | |
| SCHEMBL5142464 | 0.74 | — | — |
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-20070072970-A1 | Flame-proofed polyamide molding materials and the use thereof | EMS-CHEMIE AG (CH) | 2007-03-29 | — | — | US | disclosed |