⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14701182 | 0.84 | THRB (0.38) | — | |
| SCHEMBL17685112 | 0.84 | — | — | |
| SCHEMBL22436892 | 0.84 | — | — | |
| SCHEMBL9593011 | 0.77 | TDP1 (0.32) | — | |
| SCHEMBL9593013 | 0.77 | TDP1 (0.32) | — | |
| SCHEMBL9595178 | 0.77 | TDP1 (0.32) | — | |
| SCHEMBL9013216 | 0.72 | — | — | |
| SCHEMBL21903092 | 0.70 | — | — | |
| SCHEMBL27119571 | 0.70 | — | — | |
| SCHEMBL17652513 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3538531-A1 | BMP POTENTIATORS | Novartis AG (CH) | 2019-09-18 | — | — | EP | disclosed |
| CN-109923118-A | BMP POTENTIATORS | 诺华股份有限公司 | 2019-06-21 | — | — | CN | disclosed |
| WO-2018087677-A1 | BMP POTENTIATORS | NOVARTIS AG (CH) | 2018-05-17 | — | — | WO | disclosed |