⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30758023 | 0.85 | — | — | |
| SCHEMBL24660876 | 0.84 | CA2 (0.33) | — | |
| SCHEMBL8214229 | 0.84 | CA2 (0.33) | — | |
| SCHEMBL11212684 | 0.78 | ANPEP (0.38) | — | |
| SCHEMBL11456299 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL1870217 | 0.74 | — | — | |
| SCHEMBL10848367 | 0.74 | — | — | |
| SCHEMBL8469892 | 0.73 | CA12 (0.32) | — | |
| SCHEMBL14002497 | 0.72 | — | — | |
| SCHEMBL1604993 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20030084658-A1 | Process for reducing pollutants from the exhaust of a diesel engine using a water diesel fuel in combination with exhaust after-treatments | BROWN KEVIN F | 2003-05-08 | — | — | US | disclosed |
| EP-1294467-A2 | A PROCESS FOR REDUCING POLLUTANTS FROM THE EXHAUST OF A DIESEL ENGINE | THE LUBRIZOL CORPORATION (US) | 2003-03-26 | — | — | EP | disclosed |
| WO-2001097952-A2 | A PROCESS FOR REDUCING POLLUTANTS FROM THE EXHAUST OF A DIESEL ENGINE | THE LUBRIZOL CORPORATION (US) | 2001-12-27 | — | — | WO | disclosed |
| US-20010020344-A1 | Emulsifier for an aqueous hydrocarbon fuel | LUBRIZOL CORPORATION, THE | 2001-09-13 | — | — | US | disclosed |