⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19203381 | 1.00 | — | — | |
| SCHEMBL96407 | 1.00 | — | — | |
| SCHEMBL1766511 | 0.98 | MAOB (0.30) | — | |
| SCHEMBL1705521 | 0.91 | MAOB (0.34) | — | |
| SCHEMBL407001 | 0.80 | — | — | |
| SCHEMBL2285548 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL2281979 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL2285382 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL2283394 | 0.80 | ALDH1A1 (0.32) | — | |
| SCHEMBL2278858 | 0.80 | ALDH1A1 (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 |
|---|---|---|---|---|---|---|---|
| US-9840631-B2 | Polysiloxane/fluorinated POSS hybrid coatings, preparation and anti-icing application thereof | TIANJIN UNIVERSITY (CN) | 2017-12-12 | — | — | US | disclosed |
| US-20170218209-A1 | POLYSILOXANE/FLUORINATED POSS HYBRID COATINGS, PREPARATION AND ANTI-ICING APPLICATION THEREOF | ICING APPLICATION THEREOF | 2017-08-03 | — | — | US | disclosed |