Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | LTA4H | P09960 | 3/20 | 0.38 |
| ▸ | FABP6 | P51161 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | EBP | Q15125 | 1/20 | 0.36 |
| ▸ | DHCR7 | Q9UBM7 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6824647 | 0.93 | KMT2A (0.42) | NPC1RAB9AALDH1A1HPGDTSHR | |
| SCHEMBL6823289 | 0.89 | ALDH1A1 (0.37) | NPC1RAB9AALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL6820550 | 0.83 | NPC1 (0.42) | NPC1RAB9AALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL6826721 | 0.81 | MEN1 (0.45) | NPC1RAB9AALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL6820561 | 0.80 | UTS2R (0.45) | MEN1KMT2A | |
| SCHEMBL6462625 | 0.77 | SIGMAR1 (0.52) | — | |
| SCHEMBL6823437 | 0.76 | TSHR (0.41) | ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL6458570 | 0.73 | POLB (0.49) | LTA4H | |
| SCHEMBL6824170 | 0.72 | LMNA (0.47) | TSHRMEN1KMT2A | |
| SCHEMBL6422310 | 0.70 | MTNR1A (0.36) | ALDH1A1SMN1; SMN2TSHRKDM4E |
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-2004076444-A2 | NOVEL HYDROXYCOUMARANONE DERIVATIVES AS ANTITUMOR AND ANTIMETASTATIC | F. HOFFMANN-LA ROCHE AG (CH) | 2004-09-10 | — | — | WO | claimed |
| WO-2004076444-A2 | NOVEL HYDROXYCOUMARANONE DERIVATIVES AS ANTITUMOR AND ANTIMETASTATIC | F. HOFFMANN-LA ROCHE AG (CH) | 2004-09-10 | — | — | WO | disclosed |