⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL93362 | 0.97 | — | — | |
| SCHEMBL8671776 | 0.97 | ALDH1A1 (0.56) | — | |
| SCHEMBL29155310 | 0.94 | ALDH1A1 (0.53) | — | |
| SCHEMBL20478152 | 0.94 | — | — | |
| SCHEMBL29053186 | 0.94 | ALDH1A1 (0.53) | — | |
| SCHEMBL6053449 | 0.94 | — | — | |
| SCHEMBL9354989 | 0.94 | ALDH1A1 (0.53) | — | |
| Acetone SCHEMBL9742260 | 0.94 | ALDH1A1 (0.53) | — | |
| SCHEMBL20481945 | 0.94 | — | — | |
| SCHEMBL1618235 | 0.94 | ALDH1A1 (0.53) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4042603-A | SUBSTITUTED DIBENZOFURAN OR 9-FLUORENONE FROM A DIPHENYL ETHER OR BENZOPHENONE | UBE INDUSTRIES, LTD. (JA) | 1977-08-16 | — | — | US | claimed |
| US-4044043-A | HYPERTENSIVE AGENTS, MICROBIOCIDES | AMERICAN CYANAMID COMPANY (US) | 1977-08-23 | — | — | US | disclosed |
| US-4042603-A | SUBSTITUTED DIBENZOFURAN OR 9-FLUORENONE FROM A DIPHENYL ETHER OR BENZOPHENONE | UBE INDUSTRIES, LTD. (JA) | 1977-08-16 | — | — | US | disclosed |