⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL8571909 | 1.00 | — | — | |
| SCHEMBL2708 | 0.94 | — | — | |
| SCHEMBL80932 | 0.94 | — | — | |
| SCHEMBL179822 | 0.94 | — | — | |
| SCHEMBL15756084 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL27581591 | 0.89 | — | — | |
| Ethylene SCHEMBL6749355 | 0.84 | — | — | |
| Ethylene SCHEMBL6749365 | 0.84 | — | — | |
| SCHEMBL8445419 | 0.80 | — | — | |
| Propene SCHEMBL28641199 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102361902-A | Prepreg and molded body produced therefrom at low temperature | EVONIK DEGUSSA GMBH | 2012-02-22 | — | — | CN | disclosed |