⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27567160 | 0.76 | — | — | |
| SCHEMBL3883020 | 0.74 | — | — | |
| SCHEMBL3885051 | 0.74 | — | — | |
| SCHEMBL6676321 | 0.68 | — | — | |
| SCHEMBL29824277 | 0.68 | — | — | |
| SCHEMBL2488615 | 0.68 | — | — | |
| SCHEMBL5848037 | 0.67 | — | — | |
| SCHEMBL29620626 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL30504271 | 0.67 | — | — | |
| SCHEMBL30504292 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1776378-B1 | PROCESS FOR THE PREPARATION 2-SUBSTITUTED-DERIVATIVES OF ESTRONE AND ESTRADIOL | ORGANON NV (NL) | 2009-11-04 | — | — | EP | disclosed |
| EP-0059146-B1 | MEDICAMENTS DERIVED FROM 3-HYDROXY DODECAHYDRO BENZ(E) INDEN-7-ON, PRODUCTS DERIVED FROM 3-HYDROXY DODECAHYDRO BENZ(E) INDEN-7-ON AND PROCESS FOR THEIR PREPARATION | ROUSSEL-UCLAF (FR) | 1985-09-25 | — | — | EP | disclosed |
| EP-0059146-A1 | Medicaments derived from 3-hydroxy dodecahydro benz(e) inden-7-on, products derived from 3-hydroxy dodecahydro benz(e) inden-7-on and process for their preparation | ROUSSEL-UCLAF (FR) | 1982-09-01 | — | — | EP | disclosed |