⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20359759 | 0.84 | — | — | |
| SCHEMBL28150808 | 0.78 | — | — | |
| Propane SCHEMBL27920210 | 0.75 | KDM4E (0.30) | — | |
| SCHEMBL6036754 | 0.75 | — | — | |
| SCHEMBL28151730 | 0.75 | — | — | |
| Butane SCHEMBL27875905 | 0.73 | — | — | |
| SCHEMBL28151847 | 0.72 | — | — | |
| SCHEMBL124698 | 0.72 | — | — | |
| SCHEMBL28268201 | 0.71 | — | — | |
| Alcohol SCHEMBL15105323 | 0.71 | ALDH1A1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008054434-A2 | POLYMER COMPOSITE WITH SILANE COATED NANOPARTICLES | EASTMAN KODAK COMPANY (US) | 2008-05-08 | — | — | WO | disclosed |
| US-20070160826-A1 | Polymer composite with silane coated nanoparticles | EASTMAN KODAK COMPANY | 2007-07-12 | — | — | US | disclosed |