Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.73 |
| ▸ | MAPT | P10636 | 3/20 | 0.73 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.62 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.62 |
| ▸ | TSHR | P16473 | 3/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.62 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.62 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.62 |
| ▸ | HTR2B | P41595 | 1/20 | 0.62 |
| ▸ | KCNH3 | Q9ULD8 | 6/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL18660199 | 0.98 | ALDH1A1 (0.70) | ALDH1A1MAPTHSD17B10L3MBTL1ALOX12 | |
| SCHEMBL19018359 | 0.98 | ALDH1A1 (0.70) | ALDH1A1MAPTHSD17B10L3MBTL1ALOX12 | |
| SCHEMBL18660198 | 0.98 | ALDH1A1 (0.70) | ALDH1A1MAPTHSD17B10L3MBTL1ALOX12 | |
| SCHEMBL18660177 | 0.98 | ALDH1A1 (0.70) | ALDH1A1MAPTHSD17B10L3MBTL1ALOX12 | |
| SCHEMBL19018136 | 0.90 | ALDH1A1 (0.68) | ALDH1A1MAPTHSD17B10L3MBTL1ALOX12 | |
| SCHEMBL4970157 | 0.90 | ALDH1A1 (0.89) | ALDH1A1MAPTHSD17B10L3MBTL1TDP1 | |
| SCHEMBL9579878 | 0.90 | ALDH1A1 (0.59) | ALDH1A1MAPTHSD17B10L3MBTL1ALOX12 | |
| SCHEMBL809502 | 0.90 | KCNH3 (0.65) | ALDH1A1MAPTHSD17B10L3MBTL1ALOX12 | |
| SCHEMBL809713 | 0.88 | KCNH3 (0.63) | ALDH1A1MAPTHSD17B10L3MBTL1ALOX12 | |
| SCHEMBL1851675 | 0.88 | KCNH3 (0.63) | ALDH1A1MAPTHSD17B10L3MBTL1ALOX12 |
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-1299073-A2 | AGENTS FOR COLOURING KERATIN FIBRES, CONTAINING DERIVATIVES OF BENZO(B)FURANE-3-ONE AND/OR BENZO(B)THIOPHENE-3-ONE | Henkel Kommanditgesellschaft auf Aktien (DE) | 2003-04-09 | — | — | EP | disclosed |
| WO-2002000180-A2 | AGENTS FOR COLOURING KERATIN FIBRES, CONTAINING DERIVATIVES OF BENZO[B]FURANE-3-ONE AND/OR BENZO[B]THIOPHENE-3-ONE | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2002-01-03 | — | — | WO | disclosed |