⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2659047 | 0.79 | — | — | |
| SCHEMBL170153 | 0.76 | — | — | |
| SCHEMBL28598493 | 0.76 | — | — | |
| SCHEMBL7981772 | 0.73 | — | — | |
| SCHEMBL10783528 | 0.73 | — | — | |
| SCHEMBL11801063 | 0.71 | TDP1 (0.33) | — | |
| Trimethylammonium SCHEMBL27447179 | 0.70 | LMNA (0.46) | — | |
| Acetic Acid SCHEMBL28813454 | 0.69 | FFAR3 (0.41) | — | |
| SCHEMBL6721940 | 0.67 | — | — | |
| SCHEMBL12639997 | 0.67 | — | — |
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-117561250-A | Heterocyclic compound and harmful arthropod control composition containing same | 住友化学株式会社 | 2024-02-13 | — | — | CN | disclosed |
| CN-117545356-A | Heterocyclic compound and method for controlling drug-resistant harmful arthropods by using composition containing same | 住友化学株式会社 | 2024-02-09 | — | — | CN | disclosed |
| CN-116997542-A | Phenylacetic acid derivatives, use thereof and intermediates for the manufacture thereof | 住友化学株式会社 | 2023-11-03 | — | — | CN | disclosed |
| CN-112839505-B | Phenylpyrazole compound and method for controlling plant disease | 住友化学株式会社 | 2023-06-06 | — | — | CN | disclosed |