⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20208630 | 0.91 | P2RX4 (0.30) | — | |
| SCHEMBL20208937 | 0.84 | MAPT (0.32) | — | |
| SCHEMBL22145875 | 0.82 | NPY5R (0.31) | — | |
| SCHEMBL22145897 | 0.82 | — | — | |
| SCHEMBL19035954 | 0.82 | EDNRB (0.31) | — | |
| SCHEMBL20208970 | 0.82 | MEN1 (0.30) | — | |
| SCHEMBL22812481 | 0.82 | ALDH1A1 (0.37) | — | |
| SCHEMBL20208711 | 0.81 | ALDH1A1 (0.33) | — | |
| SCHEMBL20208709 | 0.81 | ALDH1A1 (0.33) | — | |
| SCHEMBL20209210 | 0.81 | P2RX4 (0.31) | — |
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-3544986-B1 | BRIDGED TRIARYLAMINES FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2020-12-23 | — | — | EP | disclosed |
| WO-2018095839-A1 | BRIDGED TRIARYLAMINES FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2018-05-31 | — | — | WO | disclosed |