⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2699 | 0.98 | — | — | |
| SCHEMBL27856350 | 0.95 | — | — | |
| SCHEMBL27842978 | 0.95 | — | — | |
| Arsenic SCHEMBL28293828 | 0.95 | — | — | |
| SCHEMBL26698257 | 0.95 | — | — | |
| SCHEMBL27277955 | 0.95 | — | — | |
| SCHEMBL28473046 | 0.95 | — | — | |
| SCHEMBL27315293 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL27948297 | 0.95 | — | — | |
| SCHEMBL27271203 | 0.93 | CA4 (0.44) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102802793-B | Catalyst for the hydrogenation of unsaturated compounds | DYNASOL ELASTOMEROS SA | 2015-04-08 | — | — | CN | claimed |
| CN-102802793-A | Catalyst for the hydrogenation of unsaturated compounds | DYNASOL ELASTOMEROS SA | 2012-11-28 | — | — | CN | claimed |
| CN-102802793-B | Catalyst for the hydrogenation of unsaturated compounds | DYNASOL ELASTOMEROS SA | 2015-04-08 | — | — | CN | disclosed |
| CN-102802793-A | Catalyst for the hydrogenation of unsaturated compounds | DYNASOL ELASTOMEROS SA | 2012-11-28 | — | — | CN | disclosed |