⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23969829 | 0.95 | — | — | |
| SCHEMBL21448655 | 0.92 | — | — | |
| SCHEMBL24599597 | 0.86 | — | — | |
| SCHEMBL12400893 | 0.84 | — | — | |
| SCHEMBL91252 | 0.81 | — | — | |
| SCHEMBL20149083 | 0.79 | — | — | |
| SCHEMBL24462642 | 0.79 | — | — | |
| SCHEMBL19070789 | 0.79 | — | — | |
| SCHEMBL20226509 | 0.78 | NOS2 (0.33) | — | |
| SCHEMBL24611232 | 0.78 | — | — |
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 |