Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | RAB9A | P51151 | 5/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11816273 | 0.86 | SMN1; SMN2 (0.42) | SMN1; SMN2ALDH1A1MAPK1TDP1TSHR | |
| SCHEMBL17700331 | 0.83 | ALDH1A1 (0.45) | SMN1; SMN2ALDH1A1MAPK1TDP1TSHR | |
| SCHEMBL988620 | 0.83 | POLB (0.47) | SMN1; SMN2ALDH1A1TDP1MAPTKDM4E | |
| SCHEMBL6898820 | 0.80 | ALDH1A1 (0.45) | SMN1; SMN2ALDH1A1MAPK1TDP1TSHR | |
| SCHEMBL9080527 | 0.80 | PRKCQ (0.43) | ALDH1A1MAPK1CES2CES1MAPT | |
| SCHEMBL11069800 | 0.78 | ALDH1A1 (0.36) | SMN1; SMN2ALDH1A1MAPK1TDP1TSHR | |
| SCHEMBL11067420 | 0.77 | BCL2 (0.35) | SMN1; SMN2ALDH1A1MAPK1TDP1TSHR | |
| SCHEMBL437664 | 0.76 | ESR1 (0.53) | ALDH1A1MAPTNPC1KDM4EMEN1 | |
| SCHEMBL3537531 | 0.75 | CNR1 (0.44) | SMN1; SMN2ALDH1A1MAPK1TDP1TSHR | |
| SCHEMBL20349586 | 0.74 | ALDH1A1 (0.47) | SMN1; SMN2ALDH1A1MAPK1TDP1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025010311-A1 | UREA-CONTAINING AGONISTS OF OREXIN RECEPTOR TYPE 2 | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2025-01-09 | — | — | WO | disclosed |