⚠ 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 SCHEMBL3635403 | 0.92 | — | — | |
| Water SCHEMBL3942297 | 0.89 | — | — | |
| Bromide SCHEMBL273016 | 0.89 | — | — | |
| Phosphoric Acid SCHEMBL4397366 | 0.84 | — | — | |
| SCHEMBL19638721 | 0.84 | — | — | |
| SCHEMBL3712659 | 0.83 | — | — | |
| Acetic Acid SCHEMBL302240 | 0.82 | — | — | |
| Oxalic Acid SCHEMBL17729888 | 0.81 | — | — | |
| Thiocyanic Acid SCHEMBL454040 | 0.80 | CYP2A6 (0.32) | — | |
| SCHEMBL693302 | 0.78 | LMNA (0.30) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3229611-A2 | COMPOUNDS THAT MODULATE FATTY ACID RECEPTOR ACTIVITY AND PET FOOD PRODUCTS CONTAINING THE SAME | Mars, Incorporated (US) | 2017-10-18 | — | — | EP | disclosed |
| EP-3075016-A1 | DYE-SENSITIZED SOLAR CELL | Ricoh Company, Ltd. (JP) | 2016-10-05 | — | — | EP | disclosed |
| WO-2016094726-A2 | COMPOUNDS THAT MODULATE FATTY ACID RECEPTOR ACTIVITY AND PET FOOD PRODUCTS CONTAINING THE SAME | MARS, INCORPORATED (US) | 2016-06-16 | — | — | WO | disclosed |
| WO-2015080296-A1 | DYE-SENSITIZED SOLAR CELL | RICOH COMPANY, LTD. (JP) | 2015-06-04 | — | — | WO | disclosed |