⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17499002 | 0.93 | — | — | |
| SCHEMBL3542104 | 0.91 | ALDH1A1 (0.32) | — | |
| SCHEMBL4734754 | 0.82 | MCL1 (0.34) | — | |
| Water SCHEMBL31084442 | 0.82 | MCL1 (0.34) | — | |
| SCHEMBL28015047 | 0.81 | MCL1 (0.33) | — | |
| SCHEMBL1341696 | 0.78 | ALDH1A1 (0.37) | — | |
| SCHEMBL8336738 | 0.76 | CES2 (0.39) | — | |
| SCHEMBL9836697 | 0.71 | TSHR (0.39) | — | |
| SCHEMBL2147379 | 0.71 | ALDH1A1 (0.32) | — | |
| SCHEMBL7703895 | 0.71 | AKR1B1 (0.34) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108265528-B | Protective gloves and manufacturing method thereof | 东营百华石油技术开发有限公司 | 2021-02-19 | — | — | CN | disclosed |
| CN-108252111-B | Temperature-variable textile and manufacturing method thereof | 温州远大服饰有限公司 | 2020-06-26 | — | — | CN | disclosed |
| WO-2016025747-A1 | NONLINEAR COPOLYMERS AS INTRACELLULAR DELIVERY VEHICLES AND RELATED METHODS | STAYTON PATRICK S (US) | 2016-02-18 | — | — | WO | disclosed |