⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL465229 | 0.95 | — | — | |
| SCHEMBL566243 | 0.69 | — | — | |
| SCHEMBL9581027 | 0.66 | — | — | |
| SCHEMBL465230 | 0.61 | — | — | |
| SCHEMBL4456927 | 0.60 | — | — | |
| SCHEMBL9462327 | 0.58 | — | — | |
| SCHEMBL29004419 | 0.58 | ALDH1A1 (0.33) | — | |
| SCHEMBL340170 | 0.57 | TSHR (0.36) | — | |
| Propene SCHEMBL27943182 | 0.56 | LMNA (0.38) | — | |
| SCHEMBL7876399 | 0.56 | — | — |
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-5514827-A | CROSSLINKING SILICONE RUBBERS, CAULKS, SEALS | OSI SPECIALTIES, INC. (US) | 1996-05-07 | — | — | US | claimed |
| US-5514827-A | CROSSLINKING SILICONE RUBBERS, CAULKS, SEALS | OSI SPECIALTIES, INC. (US) | 1996-05-07 | — | — | US | disclosed |