⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19869552 | 0.94 | — | — | |
| SCHEMBL19863893 | 0.94 | CYP17A1 (0.31) | — | |
| SCHEMBL19863835 | 0.92 | PDK2 (0.32) | — | |
| SCHEMBL19869532 | 0.92 | — | — | |
| SCHEMBL19863840 | 0.90 | CYP17A1 (0.31) | — | |
| SCHEMBL19869546 | 0.90 | — | — | |
| SCHEMBL19862323 | 0.90 | — | — | |
| SCHEMBL19862292 | 0.90 | — | — | |
| SCHEMBL19863899 | 0.88 | CYP17A1 (0.31) | — | |
| SCHEMBL19869551 | 0.87 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10693075-B2 | Spiro compound and organic electronic device comprising the same | SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) | 2020-06-23 | — | — | US | disclosed |
| US-20180047907-A1 | COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME | NICHEM FINE TECHNOLOGY CO., LTD. (TW) | 2018-02-15 | — | — | US | disclosed |
| US-20180047907-A1 | COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME | NICHEM FINE TECHNOLOGY CO., LTD. (TW) | 2018-02-15 | — | — | US | disclosed |