⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2214385 | 0.80 | — | — | |
| SCHEMBL151310 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL29030567 | 0.69 | TSHR (0.39) | — | |
| SCHEMBL2769648 | 0.68 | — | — | |
| SCHEMBL8762563 | 0.68 | — | — | |
| SCHEMBL464895 | 0.67 | — | — | |
| SCHEMBL7790689 | 0.66 | — | — | |
| SCHEMBL30180013 | 0.66 | — | — | |
| Acetic Acid SCHEMBL651110 | 0.66 | TSHR (0.57) | — | |
| SCHEMBL29156827 | 0.65 | TSHR (0.31) | — |
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-112513211-B | Hot melt adhesive, reinforcing tape, and flexible flat cable using the same to reinforce conductor terminals | 理研科技株式会社 | 2023-06-27 | — | — | CN | disclosed |
| CN-115996977-A | Elastomeric compositions comprising phenolic compounds and monosaccharide families | 米其林集团总公司 | 2023-04-21 | — | — | CN | disclosed |
| CN-108291051-B | Polyolefin compositions | 美利肯公司 | 2021-03-30 | — | — | CN | disclosed |