⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16604693 | 0.74 | CHRM4 (0.34) | — | |
| SCHEMBL16604682 | 0.72 | ADORA3 (0.33) | — | |
| SCHEMBL16604685 | 0.71 | MCHR1 (0.33) | — | |
| SCHEMBL16604680 | 0.69 | — | — | |
| SCHEMBL16659887 | 0.69 | USP2 (0.31) | — | |
| SCHEMBL16604726 | 0.64 | ADORA3 (0.34) | — | |
| SCHEMBL24802393 | 0.61 | ADORA3 (0.33) | — | |
| SCHEMBL16604694 | 0.60 | MCHR1 (0.39) | — | |
| SCHEMBL16604690 | 0.60 | CHRM4 (0.39) | — | |
| SCHEMBL16659882 | 0.60 | USP2 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230234936-A1 | COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF | LEADINGTAC PHARMACEUTICAL (SHAOXING) CO., LTD. (CN) | 2023-07-27 | — | — | US | disclosed |
| US-20170035766-A1 | IRAK INHIBITORS AND USES THEREOF | NIMBUS IRIS INC (US) | 2017-02-09 | — | — | US | disclosed |
| US-9518065-B2 | IRAK inhibitors and uses thereof | NIMBUS IRIS, INC. (US) | 2016-12-13 | — | — | US | disclosed |
| US-20150094305-A1 | IRAK INHIBITORS AND USES THEREOF | NIMBUS IRIS, INC. | 2015-04-02 | — | — | US | disclosed |