⚠ 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 | |
|---|---|---|---|---|
| Carbon Monoxide SCHEMBL1132614 | 0.92 | — | — | |
| Formaldehyde SCHEMBL15662280 | 0.83 | — | — | |
| Carbon Monoxide SCHEMBL1133088 | 0.81 | — | — | |
| SCHEMBL28247343 | 0.80 | ACHE (0.32) | — | |
| Carbon Monoxide SCHEMBL1132660 | 0.79 | ACHE (0.33) | — | |
| Carbon Monoxide SCHEMBL1133118 | 0.78 | ACHE (0.35) | — | |
| Carbon Monoxide SCHEMBL1254257 | 0.78 | ACHE (0.35) | — | |
| Carbon Monoxide SCHEMBL1133092 | 0.78 | ACHE (0.35) | — | |
| SCHEMBL4020993 | 0.76 | — | — | |
| Carbon Monoxide SCHEMBL1132576 | 0.75 | — | — |
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-8870981-B2 | Additive fuel composition, and method of use thereof | INNOSPEC LIMITED (GB) | 2014-10-28 | — | — | US | disclosed |
| US-20130183628-A1 | ADDITIVE FUEL COMPOSITION, AND METHOD OF USE THEREOF | INNOSPEC LIMITED (GB) | 2013-07-18 | — | — | US | disclosed |