⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5655040 | 0.78 | TSHR (0.36) | — | |
| SCHEMBL1533719 | 0.76 | HMGCR (0.42) | — | |
| SCHEMBL11773613 | 0.71 | TSHR (0.42) | — | |
| SCHEMBL3030008 | 0.70 | HMGCR (0.49) | — | |
| SCHEMBL10540472 | 0.70 | HMGCR (0.49) | — | |
| SCHEMBL28437823 | 0.70 | HMGCR (0.49) | — | |
| SCHEMBL9492593 | 0.68 | — | — | |
| SCHEMBL6545408 | 0.68 | — | — | |
| SCHEMBL8893382 | 0.64 | HMGCR (0.33) | — | |
| SCHEMBL8385155 | 0.64 | HMGCR (0.44) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118058288-A | Sterilization composition and application thereof | 沈阳中化农药化工研发有限公司 | 2024-05-24 | — | — | CN | disclosed |
| CN-111770923-B | Heterocyclic compound and harmful arthropod control agent containing same | 住友化学株式会社 | 2024-04-09 | — | — | CN | disclosed |
| CN-117016550-A | Sterilization composition and application thereof | 沈阳中化农药化工研发有限公司 | 2023-11-10 | — | — | CN | disclosed |
| CN-117016551-A | Sterilization composition and application thereof | 沈阳中化农药化工研发有限公司 | 2023-11-10 | — | — | CN | disclosed |
| CN-111918865-B | Heterocyclic compound and harmful arthropod control composition containing same | 住友化学株式会社 | 2023-10-27 | — | — | CN | disclosed |
| CN-111303116-B | Microbiocidal heterobicyclic derivatives | 先正达参股股份有限公司 | 2023-10-10 | — | — | CN | disclosed |
| CN-116711727-A | Sterilization composition and application thereof | 沈阳中化农药化工研发有限公司 | 2023-09-08 | — | — | CN | disclosed |