⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8465324 | 0.98 | — | — | |
| SCHEMBL8778235 | 0.81 | FDPS (0.41) | — | |
| SCHEMBL8778371 | 0.81 | CHRNB2 (0.33) | — | |
| Hydrochloric Acid SCHEMBL8465508 | 0.80 | FDPS (0.40) | — | |
| SCHEMBL8778259 | 0.80 | FDPS (0.38) | — | |
| Hydrochloric Acid SCHEMBL8468414 | 0.80 | CHRNB2 (0.33) | — | |
| Hydrochloric Acid SCHEMBL8467287 | 0.79 | FDPS (0.37) | — | |
| SCHEMBL9081574 | 0.76 | ANPEP (0.40) | — | |
| SCHEMBL8778160 | 0.73 | FDPS (0.44) | — | |
| Hydrochloric Acid SCHEMBL8468392 | 0.71 | FDPS (0.42) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0648120-B1 | USE OF PHOSPHONATES FOR THE TREATMENT OF OSTEOPOROSIS | PROCTER & GAMBLE PHARMA (US) | 1997-12-29 | — | — | EP | claimed |