⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7562867 | 0.79 | — | — | |
| SCHEMBL13714367 | 0.77 | LMNA (0.30) | — | |
| SCHEMBL2030789 | 0.77 | NFKB1 (0.30) | — | |
| SCHEMBL14506135 | 0.73 | — | — | |
| SCHEMBL9748128 | 0.70 | — | — | |
| SCHEMBL15711452 | 0.70 | — | — | |
| SCHEMBL9390318 | 0.70 | TSHR (0.37) | — | |
| SCHEMBL17727828 | 0.69 | ALDH1A1 (0.30) | — | |
| SCHEMBL13528383 | 0.69 | — | — | |
| SCHEMBL20742028 | 0.69 | CHRM2 (0.38) | — |
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-20070189994-A1 | Light protecting composition with reduced total amount of uv filter containing a polysiloxane-based uv filter | DSM IP ASSETS B.V. (NL) | 2007-08-16 | — | — | US | disclosed |