⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL370486 | 0.93 | — | — | |
| Bromide SCHEMBL28922827 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL28923371 | 0.91 | — | — | |
| SCHEMBL2575222 | 0.80 | — | — | |
| SCHEMBL11333074 | 0.79 | — | — | |
| SCHEMBL9725164 | 0.78 | — | — | |
| SCHEMBL27600894 | 0.77 | — | — | |
| SCHEMBL11285037 | 0.73 | — | — | |
| SCHEMBL3404376 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL29865280 | 0.72 | — | — |
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-113429962-B | Sensing microsphere integrating aggregation-induced emission fluorescent molecules and photonic crystals, and preparation method and application thereof | 公安部物证鉴定中心 | 2022-10-04 | — | — | CN | claimed |
| CN-113429962-A | Sensing microsphere integrating aggregation-induced emission fluorescent molecules and photonic crystals, and preparation method and application thereof | 公安部物证鉴定中心 | 2021-09-24 | — | — | CN | claimed |
| CN-113429962-B | Sensing microsphere integrating aggregation-induced emission fluorescent molecules and photonic crystals, and preparation method and application thereof | 公安部物证鉴定中心 | 2022-10-04 | — | — | CN | disclosed |
| CN-113429962-A | Sensing microsphere integrating aggregation-induced emission fluorescent molecules and photonic crystals, and preparation method and application thereof | 公安部物证鉴定中心 | 2021-09-24 | — | — | CN | disclosed |