⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10315764 | 1.00 | — | — | |
| SCHEMBL1726520 | 0.86 | — | — | |
| SCHEMBL15177750 | 0.75 | — | — | |
| SCHEMBL17055715 | 0.73 | — | — | |
| SCHEMBL14376910 | 0.73 | TDP1 (0.44) | — | |
| SCHEMBL9202546 | 0.69 | — | — | |
| SCHEMBL14015872 | 0.69 | — | — | |
| SCHEMBL12380261 | 0.69 | — | — | |
| SCHEMBL22652868 | 0.69 | TDP1 (0.39) | — | |
| SCHEMBL7139287 | 0.68 | TSHR (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023068814-A1 | COPOLYMER COMPOSITION AND ORGANIC-INORGANIC COMPOSITE FILM WITH ADJUSTABLE REFRACTIVE INDEX PREPARED FROM COPOLYMER-TITANIUM COMPOSITE COMPOSITION | 한국화학연구원 | 2023-04-27 | — | — | WO | disclosed |