⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL350305 | 0.84 | PPM1B (0.33) | — | |
| SCHEMBL421868 | 0.84 | PPM1B (0.33) | — | |
| SCHEMBL21747530 | 0.80 | TFPI2 (0.38) | — | |
| SCHEMBL3260089 | 0.79 | PPM1B (0.36) | — | |
| SCHEMBL3260094 | 0.79 | PPM1B (0.36) | — | |
| SCHEMBL13819231 | 0.78 | ALDH1A1 (0.35) | — | |
| SCHEMBL267820 | 0.78 | ALDH1A1 (0.35) | — | |
| SCHEMBL4179061 | 0.77 | CHRM2 (0.40) | — | |
| SCHEMBL16536409 | 0.77 | TBXA2R (0.36) | — | |
| SCHEMBL6655509 | 0.76 | PPM1B (0.35) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103879168-B | A kind of long print journey temperature-sensitive version | LUCKY HUAGUANG GRAPHICS CO., LTD. (CN) | 2016-02-17 | — | — | CN | disclosed |
| CN-103879168-A | Thermosensitive plate with long printing stroke | LUCKY HUAGUANG GRAPHICS CO LTD | 2014-06-25 | — | — | CN | disclosed |