Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.30 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18369053 | 0.81 | TSHR (0.37) | TSHRALDH1A1SMN1; SMN2DNM1 | |
| SCHEMBL7524174 | 0.79 | CA2 (0.39) | TSHRALDH1A1SMN1; SMN2CA2FDPS | |
| SCHEMBL539625 | 0.79 | TSHR (0.32) | TSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL461540 | 0.78 | — | — | |
| SCHEMBL461289 | 0.77 | — | — | |
| SCHEMBL16315511 | 0.75 | CA2 (0.37) | TSHRALDH1A1SMN1; SMN2CA2FDPS | |
| SCHEMBL17225874 | 0.75 | CA2 (0.37) | TSHRALDH1A1SMN1; SMN2CA2FDPS | |
| SCHEMBL10022171 | 0.75 | — | — | |
| SCHEMBL7529986 | 0.75 | CA2 (0.45) | CA2FDPSDNM1 | |
| SCHEMBL15178203 | 0.75 | CA2 (0.45) | CA2FDPSDNM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6673232-B2 | Compositions for mitigating coke formation in thermal cracking furnaces | ATOFINA CHEMICALS, INC. | 2004-01-06 | — | — | US | disclosed |
| US-20020029514-A1 | Compositions for mitigating coke formation in thermal cracking furnaces | ARKEMA INC. | 2002-03-14 | — | — | US | disclosed |
| EP-1176186-A2 | Composition for mitigating coke formation in thermal cracking furnaces | Atofina Chemicals, Inc. (US) | 2002-01-30 | — | — | EP | disclosed |