⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5210963 | 0.82 | — | — | |
| SCHEMBL20281973 | 0.79 | TSHR (0.37) | — | |
| SCHEMBL22222099 | 0.79 | GRM4 (0.32) | — | |
| SCHEMBL20172542 | 0.79 | LMNA (0.30) | — | |
| SCHEMBL18388137 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL29297651 | 0.78 | — | — | |
| SCHEMBL2273215 | 0.78 | — | — | |
| SCHEMBL16142531 | 0.77 | — | — | |
| SCHEMBL24192877 | 0.75 | NPSR1 (0.30) | — | |
| SCHEMBL10299526 | 0.75 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024023266-A1 | NOVEL COMPOUNDS | AC IMMUNE SA (CH) | 2024-02-01 | — | — | WO | disclosed |
| WO-2021068380-A1 | PREPARATION OF DEGRADATION COMPOUND TARGETING BTK PROTEIN, AND APPLICATION THEREOF IN TREATING AUTOIMMUNE DISEASES AND TUMORS | 清华大学 | 2021-04-15 | — | — | WO | disclosed |
| EP-3712127-A1 | NOVEL INHIBITORS OF HISTONE DEACETYLASE 10 | Deutsches Krebsforschungszentrum (DE) | 2020-09-23 | — | — | EP | disclosed |
| EP-3331859-B1 | BROAD SPECTRUM REACTIVATORS OF OPNA-INHIBITION OF HUMAN CHOLINESTERASES | CENTRE NAT RECH SCIENT (FR) | 2019-10-02 | — | — | EP | disclosed |
| US-20180138453-A1 | HIGH CONTRAST LIGHT EMITTING DEVICE | CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) | 2018-05-17 | — | — | US | disclosed |
| WO-2017021319-A1 | BROAD SPECTRUM REACTIVATORS OF OPNA-INHIBITION OF HUMAN CHOLINESTERASES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2017-02-09 | — | — | WO | disclosed |