Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| O-Xylene SCHEMBL8155397 | 0.84 | ALDH1A1 (0.53) | ALDH1A1TSHRACHEHPGDSMN1; SMN2 | |
| O-Xylene SCHEMBL510350 | 0.83 | TSHR (0.67) | ALDH1A1TSHRACHEHPGDSMN1; SMN2 | |
| O-Xylene SCHEMBL28230316 | 0.83 | TSHR (0.67) | ALDH1A1TSHRACHEHPGDSMN1; SMN2 | |
| Toluene SCHEMBL2869833 | 0.82 | LMNA (0.55) | ALDH1A1TSHRACHEHPGDSMN1; SMN2 | |
| Toluene SCHEMBL2869829 | 0.82 | LMNA (0.55) | ALDH1A1TSHRACHEHPGDSMN1; SMN2 | |
| Naphthalene SCHEMBL29016507 | 0.81 | ALDH1A1 (0.56) | ALDH1A1TSHRHPGDSMN1; SMN2KDM4E | |
| O-Xylene SCHEMBL8506142 | 0.80 | TSHR (0.62) | ALDH1A1TSHRACHEHPGDSMN1; SMN2 | |
| O-Xylene SCHEMBL1723905 | 0.80 | TSHR (0.62) | ALDH1A1TSHRACHEHPGDSMN1; SMN2 | |
| O-Xylene SCHEMBL7156831 | 0.80 | TSHR (0.62) | ALDH1A1TSHRACHEHPGDSMN1; SMN2 | |
| O-Xylene SCHEMBL11417240 | 0.80 | TSHR (0.62) | ALDH1A1TSHRACHEHPGDSMN1; SMN2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109467548-A | A kind of preparation method of imidazolidinone compound | 沈阳科创化学品有限公司 | 2019-03-15 | — | — | CN | disclosed |
| CN-100389110-C | Process of preparing aromatic ring substituted ixooxazoline compound | SHENYANG RES INST CHEMICAL IND (CN) | 2008-05-21 | — | — | CN | disclosed |
| CN-1847231-A | Process of preparing aromatic ring substituted ixooxazoline compound | SHENYANG INST OF CHEMICAL ENGI (CN) | 2006-10-18 | — | — | CN | disclosed |
| US-5498729-A | MIXED ANHYDRIDES | DOMB ABRAHAM J (IL) | 1996-03-12 | — | — | US | disclosed |
| US-5264561-A | Reaction with an acid anhydride in the presence of a catalyst such as zirconium oxide, titanium oxide, alumina and acetic anhydride | JAPAN TOBACCO INC. (JP) | 1993-11-23 | — | — | US | disclosed |
| EP-0510080-A4 | PRODRUG ANHYDRIDES OF ASPRIN, INDOMETHACIN AND IBUPROFEN, THEIR PREPARATION, COMPOSITIONS, AND ANTI-INFLAMMATORY METHOD OF USE | — | 1992-12-02 | — | — | EP | disclosed |
| EP-0510080-A1 | PRODRUG ANHYDRIDES OF ASPRIN, INDOMETHACIN AND IBUPROFEN, THEIR PREPARATION, COMPOSITIONS, AND ANTI-INFLAMMATORY METHOD OF USE | NOVA PHARMACEUTICAL CORPORATION (US) | 1992-10-28 | — | — | EP | disclosed |
| WO-1991009831-A1 | PRODRUG ANHYDRIDES OF ASPRIN, INDOMETHACIN AND IBUPROFEN, THEIR PREPARATION, COMPOSITIONS, AND ANTI-INFLAMMATORY METHOD OF USE | NOVA PHARMACEUTICAL CORPORATION (US) | 1991-07-11 | — | — | WO | disclosed |