⚠ 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 | |
|---|---|---|---|---|
| Diaminopyrimidine SCHEMBL6013998 | 0.97 | HSP90AA1 (0.48) | — | |
| Diaminopyrimidine SCHEMBL53016 | 0.97 | — | — | |
| Diaminopyrimidine SCHEMBL29389172 | 0.97 | — | — | |
| Diaminopyrimidine SCHEMBL15389244 | 0.94 | — | — | |
| Diaminopyrimidine SCHEMBL19297740 | 0.94 | — | — | |
| Diaminopyrimidine SCHEMBL793660 | 0.94 | HSP90AA1 (0.46) | — | |
| Diaminopyrimidine SCHEMBL2744765 | 0.94 | — | — | |
| Diaminopyrimidine SCHEMBL793655 | 0.94 | — | — | |
| Diaminopyrimidine SCHEMBL30978217 | 0.94 | — | — | |
| Diaminopyrimidine SCHEMBL29556978 | 0.94 | — | — |
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-117777621-A | Modified PVC plastic particle | 广东金榜塑料包装有限公司 | 2024-03-29 | — | — | CN | claimed |
| CN-117777621-A | Modified PVC plastic particle | 广东金榜塑料包装有限公司 | 2024-03-29 | — | — | CN | disclosed |