⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL907805 | 0.82 | HTT (0.33) | — | |
| SCHEMBL10791985 | 0.80 | TSHR (0.30) | — | |
| SCHEMBL148791 | 0.78 | — | — | |
| SCHEMBL4400383 | 0.78 | — | — | |
| Ethylene SCHEMBL19516509 | 0.76 | TSHR (0.37) | — | |
| SCHEMBL93534 | 0.74 | — | — | |
| SCHEMBL19105201 | 0.74 | TSHR (0.39) | — | |
| SCHEMBL1702388 | 0.74 | — | — | |
| SCHEMBL164714 | 0.74 | — | — | |
| SCHEMBL690203 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112143436-B | Preparation method of high-temperature and high-humidity resistant polyurethane adhesive | 佛山市龙源镭射科技有限公司 | 2021-05-07 | — | — | CN | claimed |
| CN-112143436-A | Preparation method of high-temperature and high-humidity resistant polyurethane adhesive | 钟雨玲 | 2020-12-29 | — | — | CN | claimed |
| CN-112143436-B | Preparation method of high-temperature and high-humidity resistant polyurethane adhesive | 佛山市龙源镭射科技有限公司 | 2021-05-07 | — | — | CN | disclosed |
| CN-112143436-A | Preparation method of high-temperature and high-humidity resistant polyurethane adhesive | 钟雨玲 | 2020-12-29 | — | — | CN | disclosed |