⚠ 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 | |
|---|---|---|---|---|
| Zinc Ion SCHEMBL6051638 | 0.94 | TSHR (0.40) | — | |
| SCHEMBL921014 | 0.94 | — | — | |
| Potassium Ion SCHEMBL7331283 | 0.94 | — | — | |
| SCHEMBL11217754 | 0.94 | TSHR (0.40) | — | |
| SCHEMBL1723575 | 0.90 | TSHR (0.37) | — | |
| SCHEMBL1723574 | 0.90 | TSHR (0.37) | — | |
| SCHEMBL11546184 | 0.90 | TSHR (0.37) | — | |
| SCHEMBL21333565 | 0.79 | CA2 (0.41) | — | |
| SCHEMBL7079894 | 0.77 | — | — | |
| SCHEMBL7899819 | 0.72 | CTSL (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5328769-A | Applying gold solutions of mercaptocarboxylic acids on bases | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1994-07-12 | — | — | US | disclosed |
| US-5312480-A | Gold(I) mercaptocarboxylic acid esters, method of their preparation and use | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1994-05-17 | — | — | US | disclosed |
| US-5235079-A | Gold coating for ceramics; conductors for integrated circuits | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1993-08-10 | — | — | US | disclosed |