⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10685081 | 1.00 | — | — | |
| SCHEMBL6972225 | 0.86 | SLC6A3 (0.32) | — | |
| SCHEMBL11293106 | 0.85 | — | — | |
| SCHEMBL11008974 | 0.84 | — | — | |
| SCHEMBL8938116 | 0.83 | — | — | |
| SCHEMBL1907284 | 0.83 | — | — | |
| SCHEMBL26926290 | 0.81 | SLC6A3 (0.31) | — | |
| SCHEMBL9756277 | 0.81 | SLC6A3 (0.31) | — | |
| SCHEMBL9042034 | 0.78 | MEN1 (0.40) | — | |
| SCHEMBL7146210 | 0.78 | SLC6A3 (0.33) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5840735-A | ESTROGEN | ENDORECHERCHE INC. (CA) | 1998-11-24 | — | — | US | disclosed |
| US-5686465-A | PROVIDE ANTIESTROGENIC EFFECTS; USEFUL IN TREATMENT OF BREAST CANCER | ENDORECHERCHE INC. (CA) | 1997-11-11 | — | — | US | disclosed |
| US-5585405-A | ADMINISTERING ANDROGEN OR ESTROGEN INHIBITORS | ENDORECHERCHE INC. (CA) | 1996-12-17 | — | — | US | disclosed |
| US-5395842-A | Inhibitors of sex steroids | ENDORECHERCHE INC. (CA) | 1995-03-07 | — | — | US | disclosed |
| US-5393785-A | Therapeutic antiestrogens | ENDORECHERCHE, INC. (CA) | 1995-02-28 | — | — | US | disclosed |
| US-5364847-A | Inhibitors of sex steroid biosynthesis and methods for their production and use | ENDORECHERCHE (CA) | 1994-11-15 | — | — | US | disclosed |
| EP-0615448-A1 | SEX STEROID ACTIVITY INHIBITORS | ENDORECHERCHE INC. (CA) | 1994-09-21 | — | — | EP | disclosed |
| WO-1993010741-A2 | SEX STEROID ACTIVITY INHIBITORS | ENDORECHERCHE INC. (CA) | 1993-06-10 | — | — | WO | disclosed |