⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26027 | 0.97 | — | — | |
| SCHEMBL28952474 | 0.95 | — | — | |
| Water SCHEMBL28352114 | 0.95 | — | — | |
| SCHEMBL6047446 | 0.95 | — | — | |
| Water SCHEMBL28067781 | 0.93 | — | — | |
| Acetic Acid SCHEMBL27588750 | 0.93 | FFAR3 (0.33) | — | |
| SCHEMBL11036728 | 0.84 | ALDH1A1 (0.37) | — | |
| SCHEMBL7170547 | 0.79 | — | — | |
| Maleic Anhydride SCHEMBL28653334 | 0.79 | — | — | |
| SCHEMBL10592960 | 0.77 | — | — |
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-109575554-A | High finished product rate laser direct forming LDS composite material and preparation method | 中广核高新核材科技（苏州）有限公司 | 2019-04-05 | — | — | CN | disclosed |