⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6949860 | 0.71 | — | — | |
| SCHEMBL13621419 | 0.69 | — | — | |
| SCHEMBL6569212 | 0.67 | — | — | |
| SCHEMBL147872 | 0.65 | — | — | |
| SCHEMBL16603059 | 0.63 | — | — | |
| SCHEMBL532363 | 0.63 | HSD17B10 (0.33) | — | |
| SCHEMBL204621 | 0.63 | HSD17B10 (0.33) | — | |
| SCHEMBL9576404 | 0.62 | — | — | |
| SCHEMBL1472166 | 0.62 | — | — | |
| SCHEMBL10019183 | 0.61 | — | — |
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-5882543-A | DEHYDRATING, PASSIVATING AND COATING HVAC AND REFRIGERATION SYSTEMS HAVING FLUID ENCLOSURES BY ADDING A COMPOSITION INCLUDING ORGANOMETALLOID AND/OR ORGANOMETALLIC COMPOUNDS TO THE SYSTEM, ALLOWING THE COMPOSITIONS TO REACT WITH WATER IN | SILICON RESOURCES, INC. (US) | 1999-03-16 | — | — | US | disclosed |
| WO-1996034067-A1 | COMPOSITIONS AND METHODS FOR DEHYDRATING, PASSIVATING AND SEALING SYSTEMS | SILICON RESOURCES, INC. (US) | 1996-10-31 | — | — | WO | disclosed |