Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | PKM | P14618 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6410088 | 0.89 | KMT2A (0.44) | ALDH1A1PKMSMN1; SMN2LMNATP53 | |
| SCHEMBL6409948 | 0.88 | KDM4E (0.47) | ALDH1A1PKMSMN1; SMN2LMNATP53 | |
| SCHEMBL7108511 | 0.86 | ALDH1A1 (0.43) | ALDH1A1PKMSMN1; SMN2LMNATP53 | |
| SCHEMBL2400969 | 0.85 | ALDH1A1 (0.58) | ALDH1A1PKMSMN1; SMN2LMNATP53 | |
| SCHEMBL6411124 | 0.81 | ALDH1A1 (0.56) | ALDH1A1PKMTP53GAAMAPT | |
| SCHEMBL6411653 | 0.81 | ALDH1A1 (0.50) | ALDH1A1PKMSMN1; SMN2LMNATP53 | |
| SCHEMBL6411043 | 0.80 | SMN1; SMN2 (0.41) | ALDH1A1PKMSMN1; SMN2LMNATP53 | |
| SCHEMBL6409851 | 0.80 | SMN1; SMN2 (0.42) | ALDH1A1PKMSMN1; SMN2LMNATP53 | |
| SCHEMBL6410302 | 0.80 | SMN1; SMN2 (0.58) | ALDH1A1PKMSMN1; SMN2LMNAGAA | |
| SCHEMBL6411568 | 0.79 | MAPT (0.50) | ALDH1A1PKMSMN1; SMN2LMNAGAA |
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-1401841-B1 | SUBSTITUTED 1-OXA-2,8-DIAZA-SPIRO 4,5]DEC-2-ENE DERIVATIVES AS MEDICAMENTS FOR THE TREATMENT OF PAIN | GRUENENTHAL GMBH (DE) | 2005-08-24 | — | — | EP | claimed |
| EP-1401841-B1 | SUBSTITUTED 1-OXA-2,8-DIAZA-SPIRO 4,5]DEC-2-ENE DERIVATIVES AS MEDICAMENTS FOR THE TREATMENT OF PAIN | GRUENENTHAL GMBH (DE) | 2005-08-24 | — | — | EP | disclosed |