⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2361514 | 0.81 | MEN1 (0.31) | — | |
| SCHEMBL34475851 | 0.81 | — | — | |
| SCHEMBL11454511 | 0.81 | — | — | |
| SCHEMBL18681183 | 0.79 | — | — | |
| SCHEMBL34475860 | 0.78 | — | — | |
| SCHEMBL9058786 | 0.77 | POLB (0.36) | — | |
| SCHEMBL28097531 | 0.76 | SLC1A3 (0.33) | — | |
| SCHEMBL27758045 | 0.76 | MEN1 (0.32) | — | |
| SCHEMBL18662934 | 0.75 | — | — | |
| SCHEMBL18662933 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-5170832-A | — | — | None | — | — | JP | disclosed |
| JP-H05170832-A | COATING RESIN COMPOSITION | CENTRAL GLASS CO LTD | 1993-07-09 | — | — | JP | disclosed |