Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | FABP3 | P05413 | 1/20 | 0.47 |
| ▸ | FABP4 | P15090 | 1/20 | 0.47 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | IAPP | P10997 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | NCF1 | P14598 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2555538 | 0.86 | FABP3 (0.54) | NPC1FABP3FABP4LIPGALDH1A1 | |
| SCHEMBL29956353 | 0.86 | FABP3 (0.54) | NPC1FABP3FABP4LIPGALDH1A1 | |
| SCHEMBL5269342 | 0.85 | SMN1; SMN2 (0.48) | ALDH1A1LMNAIAPPKMT2AMEN1 | |
| SCHEMBL15330885 | 0.84 | FABP3 (0.52) | NPC1FABP3FABP4LIPGGAA | |
| SCHEMBL6514775 | 0.79 | KEAP1 (0.53) | NPC1FABP3FABP4LIPGGAA | |
| SCHEMBL11020859 | 0.79 | GAA (0.44) | NPC1FABP3FABP4LIPGALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL7896018 | 0.78 | KEAP1 (0.52) | NPC1FABP3FABP4LIPGGAA | |
| Hydrochloric Acid SCHEMBL29156848 | 0.78 | KEAP1 (0.52) | NPC1FABP3FABP4LIPGGAA | |
| SCHEMBL8776692 | 0.77 | NCF1 (0.54) | NPC1FABP3FABP4LIPGALDH1A1 | |
| SCHEMBL12394615 | 0.77 | THRA (0.41) | NPC1FABP3FABP4ALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-103483295-B | Prepare method and the purposes of products made thereby of 3-methyl isophthalic acid-[2-(1-piperidyl) phenyl] fourth imines | 河北科技大学 | 2016-08-17 | — | — | CN | disclosed |