Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL29865471 | 0.88 | ALDH1A1 (0.33) | ALDH1A1CYP2D6 | |
| SCHEMBL22062706 | 0.84 | ALDH1A1 (0.33) | ALDH1A1CYP2D6 | |
| SCHEMBL26716190 | 0.83 | — | — | |
| SCHEMBL1952351 | 0.79 | SMN1; SMN2 (0.36) | ALDH1A1CYP2D6MTNR1A | |
| SCHEMBL29329710 | 0.79 | SMN1; SMN2 (0.36) | ALDH1A1CYP2D6MTNR1A | |
| SCHEMBL15445679 | 0.79 | ALDH1A1 (0.32) | ALDH1A1CYP2D6 | |
| SCHEMBL10354500 | 0.77 | MAPT (0.45) | ALDH1A1CYP2D6TDP1 | |
| SCHEMBL15427608 | 0.77 | ALDH1A1 (0.43) | ALDH1A1CYP2D6 | |
| SCHEMBL17190877 | 0.77 | ALDH1A1 (0.35) | ALDH1A1CYP2D6TDP1 | |
| SCHEMBL16450876 | 0.75 | ALDH1A1 (0.34) | ALDH1A1CYP2D6TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016012343-A1 | CYCLIC CARBONATE DERIVATIVES AS ANTI-SOOT ADDITIVES FOR A FUEL | RHODIA OPERATIONS (FR) | 2016-01-28 | — | — | WO | disclosed |
| EP-2977435-A1 | Cyclic carbonate derivatives as anti-soot additives for fuel | Rhodia Opérations (FR) | 2016-01-27 | — | — | EP | disclosed |