Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | PKLR | P30613 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 6/20 | 0.40 |
| ▸ | CPT2 | P23786 | 2/20 | 0.40 |
| ▸ | CPT1A | P50416 | 2/20 | 0.40 |
| ▸ | CPT1B | Q92523 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24286298 | 0.91 | ALDH1A1 (0.49) | ALDH1A1POLBCYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL24286495 | 0.89 | CYP3A4 (0.49) | ALDH1A1POLBCYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL24286809 | 0.86 | CYP2C9 (0.51) | ALDH1A1POLBCYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL24286265 | 0.85 | RORC (0.49) | POLBPKMPKLRRORC | |
| SCHEMBL24286256 | 0.82 | CYP3A4 (0.53) | ALDH1A1POLBCYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL24286304 | 0.82 | NPC1 (0.52) | ALDH1A1POLBCYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL24286286 | 0.78 | POLB (0.46) | ALDH1A1POLBCYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL24286653 | 0.75 | RORC (0.54) | RORC | |
| SCHEMBL24286546 | 0.74 | RORC (0.51) | PKMPKLRRORC | |
| SCHEMBL1818459 | 0.74 | POLB (0.47) | ALDH1A1POLBCYP3A4CYP2D6NPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3307738-B1 | ARYL DIHYDRO-2H-BENZO[B][1,4]OXAZINE SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORY AND THE TREATMENT OF DISEASE | UNIV MICHIGAN REGENTS (US) | 2022-04-20 | — | — | EP | disclosed |