⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29434185 | 0.81 | KDM4E (0.31) | — | |
| SCHEMBL158243 | 0.81 | KDM4E (0.31) | — | |
| SCHEMBL25669677 | 0.79 | GRIN2D (0.33) | — | |
| SCHEMBL21636879 | 0.74 | — | — | |
| SCHEMBL25092955 | 0.73 | — | — | |
| Naphthalene SCHEMBL1712201 | 0.73 | CYP2A6 (0.41) | — | |
| SCHEMBL29618949 | 0.72 | MAPT (0.33) | — | |
| SCHEMBL57999 | 0.72 | MAPT (0.33) | — | |
| SCHEMBL24851074 | 0.70 | — | — | |
| Ethylene SCHEMBL27864741 | 0.70 | KDM4E (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3710439-B1 | KRAS G12C INHIBITORS | MIRATI THERAPEUTICS INC (US) | 2023-02-15 | — | — | EP | disclosed |
| US-10392387-B2 | Substituted benzo[4,5]imidazo[1,2-a]phenanthro[9,10-c][1,8]naphthyridines, benzo[4,5]imidazo[1,2-a]phenanthro[9,10-c][1,5]naphthyridines and dibenzo[f,h]benzo[4,5]imidazo[2,1-a]pyrazino[2,3-c]isoquinolines as thermally assisted delayed fluorescent materials | ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2019-08-27 | — | — | US | disclosed |