⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3148508 | 0.75 | — | — | |
| SCHEMBL12056546 | 0.72 | — | — | |
| SCHEMBL15954124 | 0.72 | NOS1 (0.31) | — | |
| SCHEMBL3375995 | 0.72 | — | — | |
| SCHEMBL160277 | 0.72 | — | — | |
| SCHEMBL25215766 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL28926886 | 0.70 | — | — | |
| SCHEMBL17873460 | 0.68 | — | — | |
| SCHEMBL145521 | 0.68 | — | — | |
| SCHEMBL7724511 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023141262-A1 | BAX ACTIVATORS AND USE THEREOF | IPSEN PHARMA S.A.S. (FR) | 2023-07-27 | — | — | WO | disclosed |