Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 10/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6505996 | 0.84 | TSHR (0.47) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD | |
| SCHEMBL12164716 | 0.84 | SMN1; SMN2 (0.42) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD | |
| SCHEMBL27495595 | 0.83 | SMN1; SMN2 (0.48) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD | |
| Acetic Acid SCHEMBL27561012 | 0.82 | SMN1; SMN2 (0.44) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD | |
| SCHEMBL7368739 | 0.81 | EPHX1 (0.44) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD | |
| SCHEMBL459573 | 0.81 | EPHX1 (0.47) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD | |
| SCHEMBL476725 | 0.81 | EPHX1 (0.47) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD | |
| SCHEMBL459574 | 0.81 | EPHX1 (0.47) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD | |
| SCHEMBL7771457 | 0.79 | EPHX1 (0.46) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD | |
| Hydrochloric Acid SCHEMBL10476064 | 0.79 | EPHX1 (0.46) | ALDH1A1SMN1; SMN2RAB9ANPC1HPGD |
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-2008021235-A2 | PROCESS AND INTERMEDIATES FOR THE SYNTHESIS OF 2-(QUINOLIN-5-YL)-4,5 DISUBSTITUTED-AZOLE DERIVATIVES | SCHERING CORPORATION (US) | 2008-02-21 | — | — | WO | disclosed |