⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3937383 | 0.88 | CPN1 (0.46) | — | |
| SCHEMBL28892 | 0.86 | CPN1 (0.39) | — | |
| SCHEMBL24073205 | 0.83 | KCNH2 (0.35) | — | |
| SCHEMBL13153397 | 0.83 | KCNH2 (0.35) | — | |
| SCHEMBL3924943 | 0.81 | — | — | |
| SCHEMBL6488553 | 0.80 | — | — | |
| SCHEMBL6488556 | 0.80 | — | — | |
| SCHEMBL3719695 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL28345867 | 0.78 | SLC6A2 (0.36) | — | |
| SCHEMBL22264537 | 0.77 | KCNH2 (0.40) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115243789-A | Catalyst composition for polyurethane | 迈图高新材料公司 | 2022-10-25 | — | — | CN | disclosed |
| EP-3442977-A1 | INHIBITORS OF ACTIVIN RECEPTOR-LIKE KINASE | Blueprint Medicines Corporation (US) | 2019-02-20 | — | — | EP | disclosed |
| WO-2017181117-A1 | INHIBITORS OF ACTIVIN RECEPTOR-LIKE KINASE | BLUEPRINT MEDICINES CORPORATION (US) | 2017-10-19 | — | — | WO | disclosed |
| CN-102471369-A | Peptidic compound and use of same | UNIV KEIO | 2012-05-23 | — | — | CN | disclosed |
| WO-2009007390-A2 | 2-PYRAZ INYLBENZ IMIDAZOLE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS | ASTRAZENECA AB (SE) | 2009-01-15 | — | — | WO | disclosed |