⚠ 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 | |
|---|---|---|---|---|
| Hydrogen Sulfide SCHEMBL124624 | 1.00 | — | — | |
| Hydrogen Sulfide SCHEMBL134 | 1.00 | — | — | |
| Hydrogen Sulfide SCHEMBL11294905 | 1.00 | — | — | |
| Hydrogen Sulfide SCHEMBL2410090 | 1.00 | — | — | |
| Hydrogen Sulfide SCHEMBL1499803 | 1.00 | — | — | |
| Hydrogen Sulfide SCHEMBL1240379 | 1.00 | — | — | |
| Helium SCHEMBL27801530 | 1.00 | — | — | |
| Hydrogen Sulfide SCHEMBL1275283 | 1.00 | — | — | |
| Hydrogen Sulfide SCHEMBL5509124 | 1.00 | — | — | |
| Fluoride SCHEMBL23610938 | 0.71 | OXTR (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 |
|---|---|---|---|---|---|---|---|
| CN-113999722-A | Environment-friendly gear lubricating oil | 沈阳理工大学 | 2022-02-01 | — | — | CN | disclosed |
| WO-2007003708-A1 | PROCESS FOR THE MANUFACTURE OF DIESEL RANGE HYDROCARBONS | NESTE OIL OYJ (FI) | 2007-01-11 | — | — | WO | disclosed |
| WO-1994029411-A1 | PROCESSES FOR DESULFURIZING COAL | LEE SUNGGYU (US) | 1994-12-22 | — | — | WO | disclosed |