⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL110 | 0.71 | — | — | |
| SCHEMBL15271759 | 0.71 | — | — | |
| SCHEMBL14086857 | 0.71 | — | — | |
| SCHEMBL10005363 | 0.71 | — | — | |
| SCHEMBL175898 | 0.71 | — | — | |
| SCHEMBL7649677 | 0.58 | — | — | |
| SCHEMBL10882736 | 0.58 | — | — | |
| SCHEMBL13088830 | 0.58 | — | — | |
| SCHEMBL18053585 | 0.58 | — | — | |
| Water SCHEMBL30973806 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000033352-A1 | PHOTOTHERAPY LAMP | SCHNEIDER ALFRED (AT) | 2000-06-08 | — | — | WO | disclosed |
| EP-0225272-B1 | 1-METHYL-15-ALPHA-ALKYL-ANDROSTA-1,4-DIENE-3,17-DIONES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SCHERING AKTIENGESELLSCHAFT (DE) | 1989-04-05 | — | — | EP | disclosed |
| EP-0225272-A1 | 1-Methyl-15-alpha-alkyl-androsta-1,4-diene-3,17-diones, process for their preparation and pharmaceutical compositions containing them | SCHERING AKTIENGESELLSCHAFT (DE) | 1987-06-10 | — | — | EP | disclosed |