⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2554201 | 0.78 | — | — | |
| SCHEMBL28502512 | 0.76 | GABRA1 (0.36) | — | |
| SCHEMBL8008537 | 0.75 | — | — | |
| SCHEMBL19792665 | 0.74 | ALOX5 (0.47) | — | |
| SCHEMBL256685 | 0.72 | — | — | |
| SCHEMBL27684293 | 0.71 | GABRA1 (0.33) | — | |
| SCHEMBL11820572 | 0.71 | GABRA1 (0.37) | — | |
| SCHEMBL10943898 | 0.70 | — | — | |
| SCHEMBL9686374 | 0.70 | — | — | |
| SCHEMBL4130757 | 0.70 | MEN1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1193018-A | Process for preparing alky 2-methyl-3-furyl-disulfo ether | BEIJING LIGHT INDUSTRY COLLEGE (CN) | 1998-09-16 | — | — | CN | claimed |
| US-5824661-A | TREATMENT OF OSTEOPOROSIS, OSTEOARTHRITIS, RHEUMATOID ARTHRITIS | THE PROCTER & GAMBLE COMPANY (US) | 1998-10-20 | — | — | US | disclosed |
| CN-1193018-A | Process for preparing alky 2-methyl-3-furyl-disulfo ether | BEIJING LIGHT INDUSTRY COLLEGE (CN) | 1998-09-16 | — | — | CN | disclosed |