⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10749775 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL4659829 | 0.57 | — | — | |
| SCHEMBL7914735 | 0.57 | TSHR (0.36) | — | |
| SCHEMBL14482736 | 0.55 | — | — | |
| SCHEMBL23546 | 0.53 | — | — | |
| SCHEMBL23732 | 0.53 | — | — | |
| SCHEMBL1328 | 0.53 | — | — | |
| SCHEMBL8852489 | 0.53 | TSHR (0.54) | — | |
| SCHEMBL23116592 | 0.50 | — | — | |
| SCHEMBL20507075 | 0.50 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113980057-A | One-pot method for preparing bis (dienylrhodium) (I) nitrate [ RhL [)2]NO3Method of synthesis of | 昆明贵金属研究所 | 2022-01-28 | — | — | CN | disclosed |
| US-4444898-A | Heterocatalyst system | UNIVERSITY PATENTS, INC. (US) | 1984-04-24 | — | — | US | disclosed |
| EP-0098289-A1 | HETEROCATALYST SYSTEM | UNIVERSITY PATENTS, INC. (US) | 1984-01-18 | — | — | EP | disclosed |
| WO-1983002404-A1 | HETEROCATALYST SYSTEM | UNIVERSITY PATENTS INC (US) | 1983-07-21 | — | — | WO | disclosed |