⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL302673 | 0.95 | — | — | |
| SCHEMBL27546039 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL11142739 | 0.90 | — | — | |
| Bromide SCHEMBL27573574 | 0.90 | — | — | |
| SCHEMBL3663971 | 0.90 | — | — | |
| Bromide SCHEMBL25266022 | 0.90 | — | — | |
| Iodide SCHEMBL17495190 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL16430415 | 0.90 | TSHR (0.36) | — | |
| Hydrochloric Acid SCHEMBL27592160 | 0.90 | — | — | |
| SCHEMBL5800829 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1198831-C | Organic metal monoacylalkylphosphine compound | CIBA SC HOLDING AG (CH) | 2005-04-27 | — | — | CN | disclosed |
| CN-1329005-A | Organic metal monoacylalkylphosphine compound | CIBA SC HOLDING AG (CH) | 2002-01-02 | — | — | CN | disclosed |