Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CD44 | P16070 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18860810 | 0.79 | — | — | |
| SCHEMBL29776862 | 0.77 | TRPA1 (0.44) | TRPA1ATMCYP1A2CYP2A6CD44 | |
| SCHEMBL10696455 | 0.77 | TRPA1 (0.44) | TRPA1ATMCYP1A2CYP2A6CD44 | |
| SCHEMBL3200651 | 0.75 | TRPA1 (0.42) | TRPA1ATMCYP1A2CYP2A6CD44 | |
| SCHEMBL8967412 | 0.75 | TRPA1 (0.42) | TRPA1ATMCYP1A2CYP2A6CD44 | |
| SCHEMBL2175294 | 0.75 | TRPA1 (0.48) | TRPA1ATMCYP1A2CYP2A6CD44 | |
| SCHEMBL7768863 | 0.75 | TRPA1 (0.42) | TRPA1ATMCYP1A2CYP2A6CD44 | |
| SCHEMBL7179945 | 0.75 | TRPA1 (0.42) | TRPA1ATMCYP1A2CYP2A6CD44 | |
| SCHEMBL113990 | 0.75 | TRPA1 (0.42) | TRPA1ATMCYP1A2CYP2A6CD44 | |
| SCHEMBL7184237 | 0.75 | TRPA1 (0.42) | TRPA1ATMCYP1A2CYP2A6CD44 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117106483-A | Residual oil hydrogenation anti-coking scale inhibitor and preparation method thereof | 江苏创新石化有限公司 | 2023-11-24 | — | — | CN | claimed |
| CN-117106483-A | Residual oil hydrogenation anti-coking scale inhibitor and preparation method thereof | 江苏创新石化有限公司 | 2023-11-24 | — | — | CN | disclosed |
| US-6737193-B2 | ACTIVE MATERIALS IN THE POSITIVE ELECTRODES OF BATTERIES. NOVEL METHODS FOR PREPARING THE TETRAKETOPIPERAZINE UNIT-CONTAINING COMPOUNDS INCLUDE: (I) REACTING AN OXALYL HALIDE AND AN OXAMIDE, AND ADDING WATER OR AN AQUEOUS ALKALI | IM&T RESEARCH, INC. | 2004-05-18 | — | — | US | disclosed |
| US-20030148188-A1 | Active materials in the positive electrodes of batteries. Novel methods for preparing the tetraketopiperazine unit-containing compounds include: (i) reacting an oxalyl halide and an oxamide, and adding water or an aqueous alkali | IM&T RESEARCH, INC. | 2003-08-07 | — | — | US | disclosed |
| US-6130272-A | FLUIDIZING REINFORCING SILICA FILLER IN HIGH-SHEAR MIXER; ADDING SILYLATING AGENT, NITROGEN COMPOUND SELECTED FROM AMMONIA, AMMONIA SALTS, NON-SILYLATED PRIMARY AMINES, AND AMINOXY COMPOUNDS, WATER; ADDING POLYDIORGANOSILOXAN; HEATING | DOW CORNING CORPORATION (US) | 2000-10-10 | — | — | US | disclosed |
| EP-0783021-A2 | Process for making powdered base for formulating curable liquid silicone rubber composition | DOW CORNING CORPORATION (US) | 1997-07-09 | — | — | EP | disclosed |