⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17682193 | 0.81 | — | — | |
| SCHEMBL16224805 | 0.80 | NR1H2 (0.35) | — | |
| SCHEMBL28533140 | 0.75 | — | — | |
| SCHEMBL28532864 | 0.74 | TACR1 (0.30) | — | |
| SCHEMBL28527914 | 0.72 | CYP3A4 (0.40) | — | |
| SCHEMBL17682168 | 0.71 | APLNR (0.36) | — | |
| SCHEMBL14676680 | 0.66 | — | — | |
| SCHEMBL18377811 | 0.63 | KDM4E (0.34) | — | |
| SCHEMBL16448690 | 0.62 | APLNR (0.44) | — | |
| SCHEMBL1700392 | 0.62 | APLNR (0.30) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117683029-A | Bcl-2 inhibitors | 百济神州有限公司 | 2024-03-12 | — | — | CN | disclosed |
| CN-117430601-A | Bcl-2 inhibitors | 百济神州有限公司 | 2024-01-23 | — | — | CN | disclosed |
| CN-112437772-B | Bcl-2 inhibitors | 百济神州有限公司 | 2023-11-21 | — | — | CN | disclosed |
| CN-112437772-A | Bcl-2 inhibitors | 百济神州有限公司 | 2021-03-02 | — | — | CN | disclosed |