⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5612040 | 1.00 | — | — | |
| SCHEMBL5612049 | 1.00 | — | — | |
| SCHEMBL5459307 | 0.89 | ALDH1A1 (0.36) | — | |
| SCHEMBL491578 | 0.89 | ALDH1A1 (0.36) | — | |
| SCHEMBL4127530 | 0.89 | ALDH1A1 (0.36) | — | |
| SCHEMBL19743466 | 0.88 | — | — | |
| SCHEMBL1611506 | 0.87 | ALDH1A1 (0.32) | — | |
| SCHEMBL842418 | 0.82 | — | — | |
| SCHEMBL16099095 | 0.73 | — | — | |
| SCHEMBL2420244 | 0.71 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0652749-A4 | METHODS AND COMPOSITIONS FOR INHIBITING 5-g(a)-REDUCTASE ACTIVITY. | ARCH DEV CORP (US) | 1997-04-09 | — | — | EP | disclosed |
| US-5605929-A | REDUCING WEIGHT IN ANIMALS | ARCH DEVELOPMENT CORP. (US) | 1997-02-25 | — | — | US | disclosed |
| US-5422371-A | Contacting a cell with a fatty acid or fatty alcohol to prevent reduction of testosterone to 5a-dihydrotestosterone | ARCH DEVELOPMENT CORP. (US) | 1995-06-06 | — | — | US | disclosed |
| EP-0652749-A1 | METHODS AND COMPOSITIONS FOR INHIBITING 5$g(a)-REDUCTASE ACTIVITY | ARCH DEVELOPMENT CORPORATION (US) | 1995-05-17 | — | — | EP | disclosed |
| WO-1994001100-A1 | METHODS AND COMPOSITIONS FOR INHIBITING 5α-REDUCTASE ACTIVITY | ARCH DEVELOPMENT CORPORATION (US) | 1994-01-20 | — | — | WO | disclosed |