⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12630360 | 0.79 | — | — | |
| SCHEMBL21661675 | 0.77 | CA1 (0.33) | — | |
| SCHEMBL9152830 | 0.74 | — | — | |
| SCHEMBL6184763 | 0.72 | — | — | |
| SCHEMBL25898437 | 0.72 | — | — | |
| SCHEMBL17998042 | 0.72 | — | — | |
| SCHEMBL26617072 | 0.71 | — | — | |
| SCHEMBL5510192 | 0.71 | TAS1R3 (0.31) | — | |
| SCHEMBL10699217 | 0.71 | — | — | |
| SCHEMBL5512555 | 0.70 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018089373-A9 | STEROIDS AND PROTEIN-CONJUGATES THEREOF | REGENERON PHARMACEUTICALS, INC. (US) | 2018-07-12 | — | — | WO | disclosed |
| WO-2018089373-A2 | STEROIDS AND PROTEIN-CONJUGATES THEREOF | REGENERON PHARMACEUTICALS, INC. (US) | 2018-05-17 | — | — | WO | disclosed |