Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.37 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27754049 | 0.83 | PTGS2 (0.46) | PTGS2NLRP3ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL27078157 | 0.81 | NLRP3 (0.43) | PTGS2NLRP3ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL27078153 | 0.81 | NLRP3 (0.43) | PTGS2NLRP3ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL30175030 | 0.81 | NLRP3 (0.43) | PTGS2NLRP3ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL25923968 | 0.80 | ELANE (0.43) | ELANENLRP3ALDH1A1MEN1KMT2A | |
| SCHEMBL11477290 | 0.78 | PTGS2 (0.42) | PTGS2NLRP3ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL29418253 | 0.78 | PTGS2 (0.49) | PTGS2NLRP3ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL998947 | 0.78 | PTGS2 (0.49) | PTGS2NLRP3ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL710531 | 0.78 | KCNH2 (0.51) | PTGS2NLRP3ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL16998575 | 0.76 | PTGS2 (0.44) | PTGS2NLRP3ALDH1A1SMN1; SMN2HSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2892877-B1 | PROCESS FOR THE PREPARATION OF (S)-2-ETHYL-N-(1-METHOXYPROPAN -2-YL)-6-METHYL ANILINE | COUNCIL SCIENT IND RES (IN) | 2017-06-21 | — | — | EP | disclosed |