⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7957864 | 0.83 | TDP1 (0.38) | — | |
| SCHEMBL8902334 | 0.81 | ESR1 (0.38) | — | |
| SCHEMBL455762 | 0.79 | — | — | |
| SCHEMBL1663658 | 0.77 | — | — | |
| SCHEMBL28283318 | 0.77 | — | — | |
| SCHEMBL1637751 | 0.76 | CNR1 (0.41) | — | |
| SCHEMBL7585287 | 0.74 | — | — | |
| SCHEMBL7469143 | 0.74 | GABRA1 (0.41) | — | |
| SCHEMBL1741603 | 0.74 | SKP2 (0.48) | — | |
| SCHEMBL6444606 | 0.74 | ESR1 (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5053164-A | For high speed switching | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1991-10-01 | — | — | US | disclosed |