Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 6/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | GMNN | O75496 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 3/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 7/20 | 0.44 |
| ▸ | FAAH | O00519 | 4/20 | 0.44 |
| ▸ | PLA2G6 | O60733 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 3/20 | 0.42 |
| ▸ | PPARD | Q03181 | 3/20 | 0.42 |
| ▸ | PPARA | Q07869 | 3/20 | 0.42 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3683268 | 1.00 | CES2 (0.50) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL11441143 | 1.00 | CES2 (0.50) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL7804794 | 1.00 | CES2 (0.50) | CES2HSD17B10GMNNTP53POLB | |
| Methane SCHEMBL3725723 | 0.98 | CES2 (0.48) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL15615683 | 0.97 | CES2 (0.46) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL11543202 | 0.93 | CES2 (0.45) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL11544411 | 0.93 | CES2 (0.45) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL13135021 | 0.92 | TDP1 (0.42) | CES2HSD17B10GMNNTP53POLB | |
| SCHEMBL6234311 | 0.90 | — | — | |
| SCHEMBL11437360 | 0.89 | CES2 (0.42) | CES2HSD17B10GMNNTP53POLB |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0413562-B1 | S-ALKYLTHIOPROPIONIC ACIDS AND DERIVATIVES | WITCO CORPORATION (US) | 1993-09-01 | — | — | EP | disclosed |
| EP-0413563-B1 | SOLVENT REFINING ALKYLTHIOPROPIONIC PENTAERYTHRITOL ESTERS | WITCO CORPORATION (US) | 1993-09-01 | — | — | EP | disclosed |
| US-5198486-A | Polymer stabilizers | WITCO CORPORATION (US) | 1993-03-30 | — | — | US | disclosed |
| US-5057622-A | From alkyl mercaptan and acrylic acid | WITCO CORPORATION (US) | 1991-10-15 | — | — | US | disclosed |
| US-5055606-A | Dissolving in and recrystallizing from mixture of lower aliphatic alcohol and lower aliphatic acid ester | WITCO CORPORATION (US) | 1991-10-08 | — | — | US | disclosed |
| EP-0413563-A1 | Solvent refining alkylthiopropionic pentaerythritol esters | WITCO CORPORATION (US) | 1991-02-20 | — | — | EP | disclosed |
| EP-0413562-A1 | S-alkylthiopropionic acids and derivatives | WITCO CORPORATION (US) | 1991-02-20 | — | — | EP | disclosed |