Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.75 |
| ▸ | PPARG | P37231 | 7/20 | 0.75 |
| ▸ | PPARD | Q03181 | 7/20 | 0.75 |
| ▸ | PPARA | Q07869 | 7/20 | 0.75 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.75 |
| ▸ | TSHR | P16473 | 4/20 | 0.75 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.75 |
| ▸ | FABP4 | P15090 | 3/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.75 |
| ▸ | TLR2 | O60603 | 2/20 | 0.75 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.75 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.75 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.75 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.75 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.75 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.75 |
| ▸ | MEN1 | O00255 | 1/20 | 0.75 |
| ▸ | ESR1 | P03372 | 1/20 | 0.75 |
| ▸ | PDE4A | P27815 | 1/20 | 0.75 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.75 |
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 | |
|---|---|---|---|---|
| Hexadecane SCHEMBL27980697 | 0.97 | GPR84 (0.79) | GPR84PPARGPPARDPPARAHDAC11 | |
| Tetradecane SCHEMBL27616455 | 0.97 | GPR84 (0.79) | GPR84PPARGPPARDPPARAHDAC11 | |
| Heptane SCHEMBL7403977 | 0.97 | GPR84 (0.79) | GPR84PPARGPPARDPPARAHDAC11 | |
| Decane SCHEMBL8483044 | 0.97 | GPR84 (0.79) | GPR84PPARGPPARDPPARAHDAC11 | |
| Butyric Acid SCHEMBL608115 | 0.97 | FFAR3 (0.77) | GPR84PPARGPPARDPPARAHDAC11 | |
| Nonane SCHEMBL28234147 | 0.97 | GPR84 (0.79) | GPR84PPARGPPARDPPARAHDAC11 | |
| Octane SCHEMBL7563355 | 0.97 | GPR84 (0.79) | GPR84PPARGPPARDPPARAHDAC11 | |
| Butyric Acid SCHEMBL4783360 | 0.97 | FFAR3 (0.77) | GPR84PPARGPPARDPPARAHDAC11 | |
| Heptane SCHEMBL197691 | 0.97 | GPR84 (0.79) | GPR84PPARGPPARDPPARAHDAC11 | |
| Butyric Acid SCHEMBL2676630 | 0.94 | FFAR3 (0.72) | GPR84PPARGPPARDPPARAHDAC11 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6124352-A | DINITROBENZOIC ACID COMPOUNDS AND DERIVATIVES THEREOF | JEMLAN, LLC (US) | 2000-09-26 | — | — | US | disclosed |
| EP-0597049-A1 | ANTIFUNGAL AGENTS | JEMLAN, INC. (US) | 1994-05-18 | — | — | EP | disclosed |
| EP-0597049-A4 | ANTIFUNGAL AGENTS. | JEMLAN INC (US) | 1994-03-18 | — | — | EP | disclosed |
| WO-1993017676-A1 | ANTIFUNGAL AGENTS | JEMLAN, INC. (US) | 1993-09-16 | — | — | WO | disclosed |