⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL291308 | 0.97 | — | — | |
| SCHEMBL12396066 | 0.79 | CTSL (0.34) | — | |
| SCHEMBL292457 | 0.78 | — | — | |
| SCHEMBL20880168 | 0.76 | ANPEP (0.43) | — | |
| SCHEMBL2294201 | 0.76 | CTSL (0.40) | — | |
| SCHEMBL7750664 | 0.75 | — | — | |
| SCHEMBL24455275 | 0.75 | LMNA (0.62) | — | |
| SCHEMBL24381721 | 0.75 | LMNA (0.62) | — | |
| SCHEMBL12424292 | 0.75 | LMNA (0.62) | — | |
| Hydrochloric Acid SCHEMBL11907988 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5567849-A | Borane-sulfide hydroboration agents | ALDRICH CHEMICAL COMPANY, INC. (US) | 1996-10-22 | — | — | US | claimed |
| US-5567849-A | Borane-sulfide hydroboration agents | ALDRICH CHEMICAL COMPANY, INC. (US) | 1996-10-22 | — | — | US | disclosed |