Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7917851 | 0.84 | TSHR (0.33) | TSHR | |
| SCHEMBL20530395 | 0.84 | TSHR (0.33) | TSHR | |
| SCHEMBL12042643 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TRPA1LMNATSHR | |
| SCHEMBL1710154 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TRPA1LMNA | |
| SCHEMBL7241457 | 0.77 | ALDH1A1 (0.42) | ALDH1A1TRPA1LMNATSHR | |
| SCHEMBL6689689 | 0.75 | ALDH1A1 (0.41) | ALDH1A1 | |
| SCHEMBL7034551 | 0.75 | — | — | |
| SCHEMBL8421787 | 0.75 | — | — | |
| SCHEMBL10186953 | 0.75 | — | — | |
| SCHEMBL4006336 | 0.73 | ALDH1A1 (0.44) | ALDH1A1TRPA1LMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002085918-A1 | A FACILE SYNTHESIS OF SYMMETRIC ESTERS OF ALKYLENEBISPHOSPHONIC ACIDS | LOYOLA UNIVERSITY OF CHICAGO (US) | 2002-10-31 | — | — | WO | claimed |
| EP-0832153-A4 | BENZOATES AS FLAME RETARDANTS AND/OR PLASTICIZERS | GREAT LAKES CHEMICAL CORP (US) | 1998-08-26 | — | — | EP | disclosed |
| EP-0832153-A1 | BENZOATES AS FLAME RETARDANTS AND/OR PLASTICIZERS | GREAT LAKES CHEMICAL CORPORATION (US) | 1998-04-01 | — | — | EP | disclosed |
| WO-1996032438-A1 | BENZOATES AS FLAME RETARDANTS AND/OR PLASTICIZERS | GREAT LAKES CHEMICAL CORPORATION (US) | 1996-10-17 | — | — | WO | disclosed |