⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27475823 | 0.68 | KMT2A (0.32) | — | |
| SCHEMBL8290260 | 0.61 | CYP2A6 (0.41) | — | |
| SCHEMBL6583308 | 0.59 | CYP2A6 (0.38) | — | |
| SCHEMBL27925710 | 0.59 | CYP2A6 (0.38) | — | |
| SCHEMBL661791 | 0.59 | KMT2A (0.41) | — | |
| SCHEMBL6682404 | 0.57 | HSD11B1 (0.50) | — | |
| SCHEMBL1012805 | 0.57 | MAOB (0.39) | — | |
| SCHEMBL16691392 | 0.57 | KMT2A (0.40) | — | |
| SCHEMBL4678558 | 0.56 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL31584241 | 0.55 | CYP2A6 (0.38) | — |
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-100430049-C | Depressant of functions developed by molecule | SHOZO KOYAMA (JP) | 2008-11-05 | — | — | CN | disclosed |
| CN-1162918-A | Depressant of functions developed by molecule | KOYAMA SHOZO (JP) | 1997-10-22 | — | — | CN | disclosed |