⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8599269 | 0.74 | KMT2A (0.32) | — | |
| SCHEMBL3857564 | 0.69 | CYP19A1 (0.49) | — | |
| SCHEMBL17394853 | 0.69 | PIK3CA (0.42) | — | |
| SCHEMBL17394844 | 0.69 | PIK3CA (0.42) | — | |
| SCHEMBL17870974 | 0.66 | CYP19A1 (0.31) | — | |
| SCHEMBL17394846 | 0.64 | — | — | |
| SCHEMBL8165671 | 0.62 | LMNA (0.33) | — | |
| SCHEMBL9418504 | 0.62 | CYP19A1 (0.46) | — | |
| SCHEMBL9418511 | 0.62 | CYP19A1 (0.46) | — | |
| SCHEMBL3856204 | 0.60 | SHBG (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3034610-A1 | NOVEL TERPENOID COMPOUND AND METHOD FOR PRODUCING SAME | The Kitasato Institute (JP) | 2016-06-22 | — | — | EP | disclosed |