Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.65 |
| ▸ | HPGD | P15428 | 2/20 | 0.65 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.65 |
| ▸ | MAOB | P27338 | 3/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | MAOA | P21397 | 2/20 | 0.51 |
| ▸ | AR | P10275 | 8/20 | 0.49 |
| ▸ | LTA4H | P09960 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL523446 | 1.00 | ALDH1A1 (0.65) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL9747026 | 1.00 | ALDH1A1 (0.65) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL9745656 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL9746267 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL9746946 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL5143806 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL9747762 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL28487747 | 0.92 | ALDH1A1 (0.57) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL13908822 | 0.92 | CYP19A1 (0.65) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL1377229 | 0.92 | CYP19A1 (0.62) | ALDH1A1HPGDCYP19A1MAOBNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5118431-A | Phthalonitriles and phthalocyanines as lubricity-enhancing additives | THE DOW CHEMICAL COMPANY (US) | 1992-06-02 | — | — | US | disclosed |
| US-5061388-A | Novel phthalonitriles and phthalocyanines as lubricity-enhancing additives | THE DOW CHEMICAL COMPANY (US) | 1991-10-29 | — | — | US | disclosed |