⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7122180 | 1.00 | — | — | |
| SCHEMBL3270575 | 0.82 | — | — | |
| SCHEMBL20365804 | 0.79 | ALDH1A1 (0.38) | — | |
| SCHEMBL2386849 | 0.73 | — | — | |
| SCHEMBL20716080 | 0.73 | — | — | |
| SCHEMBL3689551 | 0.73 | OPRM1 (0.43) | — | |
| Hydrochloric Acid SCHEMBL22502098 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL21591495 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL7112987 | 0.71 | — | — | |
| Bromide SCHEMBL7191240 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6353006-B1 | TREATMENT OF BONE DISORDERS, OSTEOPOROSIS AND HEALING AGENT | BAYER CORPORATION | 2002-03-05 | — | — | US | disclosed |