⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL149994 | 0.85 | — | — | |
| SCHEMBL28843818 | 0.83 | — | — | |
| Water SCHEMBL27671405 | 0.83 | — | — | |
| Ammonia Solution, Strong SCHEMBL25202605 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL34462385 | 0.83 | — | — | |
| Benzene SCHEMBL10923496 | 0.80 | — | — | |
| Pyrrole SCHEMBL10903163 | 0.71 | — | — | |
| Water SCHEMBL18825565 | 0.67 | — | — | |
| 2-Pyrrolidone SCHEMBL17746935 | 0.61 | OR51E2 (0.48) | — | |
| SCHEMBL6022813 | 0.60 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119823356-B | Near infrared photoinduced semiconductor polymer and hydrolysate thereof, side chain modified polymer, drug delivery system, photo-stimulus response nano delivery system, and preparation method and application thereof | 南京中医药大学 | 2025-06-17 | — | — | CN | disclosed |
| CN-119823356-A | Near infrared photoinduced semiconductor polymer and hydrolysate thereof, side chain modified polymer, drug delivery system, photo-stimulus response nano delivery system, and preparation method and application thereof | 南京中医药大学 | 2025-04-15 | — | — | CN | disclosed |