⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21120066 | 1.00 | — | — | |
| SCHEMBL14941108 | 0.78 | — | — | |
| SCHEMBL22164048 | 0.74 | — | — | |
| SCHEMBL22848406 | 0.74 | HRH3 (0.38) | — | |
| SCHEMBL30804840 | 0.74 | — | — | |
| SCHEMBL24808880 | 0.72 | CYP2D6 (0.31) | — | |
| SCHEMBL12331469 | 0.70 | — | — | |
| SCHEMBL24376211 | 0.70 | — | — | |
| SCHEMBL20696519 | 0.69 | HTR1A (0.33) | — | |
| SCHEMBL21997230 | 0.68 | PDK1 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230295114-A1 | AKT3 MODULATORS | Georgiamune Inc. | 2023-09-21 | — | — | US | disclosed |
| EP-3889154-A1 | HETEROCYCLIC COMPOUND INTERMEDIATE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | Wuhan LL Science And Technology Development Co., Ltd. (CN) | 2021-10-06 | — | — | EP | disclosed |