⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7292306 | 0.85 | — | — | |
| SCHEMBL7336810 | 0.85 | — | — | |
| SCHEMBL7295264 | 0.83 | — | — | |
| SCHEMBL7430345 | 0.83 | — | — | |
| SCHEMBL7322826 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL7294722 | 0.82 | — | — | |
| SCHEMBL7392328 | 0.82 | — | — | |
| SCHEMBL7301043 | 0.81 | — | — | |
| SCHEMBL7382245 | 0.81 | — | — | |
| SCHEMBL7322452 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-5032634-A | — | — | None | — | — | JP | disclosed |
| JP-H0532634-A | PIPERIDINYLCAMPHORSULFONYL OXYTOCIN ANTAGONIST | MERCK & CO INC | 1993-02-09 | — | — | JP | disclosed |