⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12124470 | 0.87 | SLC6A2 (0.39) | — | |
| SCHEMBL3431172 | 0.80 | — | — | |
| SCHEMBL11764386 | 0.80 | — | — | |
| SCHEMBL28434937 | 0.77 | — | — | |
| SCHEMBL3431878 | 0.75 | HTR2C (0.30) | — | |
| SCHEMBL3029842 | 0.70 | — | — | |
| SCHEMBL20038566 | 0.69 | — | — | |
| SCHEMBL22579509 | 0.69 | — | — | |
| SCHEMBL2996473 | 0.69 | — | — | |
| SCHEMBL1866794 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118995607-A | Application of BMPR1B inhibitor in induced development and induced culture medium | 睿健医药科技(苏州)有限公司 | 2024-11-22 | — | — | CN | disclosed |
| CN-118994114-A | Pyrazolyl piperazinone compounds, pharmaceutical compositions and application thereof | 睿健医药科技(苏州)有限公司 | 2024-11-22 | — | — | CN | disclosed |