Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MLYCD | O95822 | 2/20 | 0.31 |
| ▸ | F10 | P00742 | 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 | |
|---|---|---|---|---|
| SCHEMBL20640969 | 0.93 | F10 (0.33) | TDP1CYP4F2CYP4A11MLYCDF10 | |
| SCHEMBL12461336 | 0.81 | CYP4F2 (0.36) | TDP1CYP4F2CYP4A11MAPTMLYCD | |
| SCHEMBL20640879 | 0.80 | MIF (0.40) | F10 | |
| SCHEMBL12461232 | 0.78 | CYP4F2 (0.37) | TDP1CYP4F2CYP4A11MAPTMLYCD | |
| Hydrochloric Acid SCHEMBL25399110 | 0.74 | CYP4F2 (0.35) | TDP1CYP4F2CYP4A11MAPTMLYCD | |
| SCHEMBL25395918 | 0.73 | MEN1 (0.43) | — | |
| SCHEMBL20640508 | 0.72 | MLYCD (0.32) | TDP1MAPTMLYCD | |
| SCHEMBL25399266 | 0.72 | ALDH1A1 (0.44) | MLYCD | |
| SCHEMBL4764842 | 0.72 | ALDH1A1 (0.38) | TDP1CYP4F2CYP4A11MAPTMLYCD | |
| SCHEMBL20640968 | 0.72 | TDP1 (0.31) | TDP1MAPTMLYCD |
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 |
|---|---|---|---|---|---|---|---|
| EP-3652178-A1 | BICYCLIC KETONE COMPOUNDS AND METHODS OF USE THEREOF | H. Hoffnabb-La Roche Ag (CH) | 2020-05-20 | — | — | EP | disclosed |
| WO-2019012063-A1 | BICYCLIC KETONE COMPOUNDS AND METHODS OF USE THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2019-01-17 | — | — | WO | disclosed |