⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25759331 | 0.76 | PKM (0.34) | — | |
| SCHEMBL25759334 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL20821300 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL25759327 | 0.70 | KMT2A (0.39) | — | |
| SCHEMBL1104969 | 0.70 | KMT2A (0.39) | — | |
| SCHEMBL25759329 | 0.66 | — | — | |
| SCHEMBL20821320 | 0.63 | ALDH1A1 (0.30) | — | |
| SCHEMBL20821302 | 0.63 | PTPRC (0.37) | — | |
| SCHEMBL20821301 | 0.61 | MAPT (0.35) | — | |
| SCHEMBL24960484 | 0.61 | MAPT (0.36) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11152581-B2 | Visibly transparent, near-infrared-absorbing donor/acceptor photovoltaic devices | UBIQUITOUS ENERGY, INC. (US) | 2021-10-19 | — | — | US | disclosed |