Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 3/20 | 0.32 |
| ▸ | CES1 | P23141 | 2/20 | 0.32 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL27458141 | 0.71 | — | — | |
| SCHEMBL11766336 | 0.65 | — | — | |
| SCHEMBL11777360 | 0.64 | FAAH (0.37) | FAAHCES1 | |
| SCHEMBL10824003 | 0.63 | KDM4E (0.42) | TP53 | |
| SCHEMBL7599679 | 0.59 | TP53 (0.33) | TP53 | |
| SCHEMBL8546354 | 0.59 | — | — | |
| SCHEMBL14893941 | 0.59 | KDM4E (0.39) | — | |
| SCHEMBL3049208 | 0.59 | ALDH1A1 (0.40) | TP53 | |
| SCHEMBL34467588 | 0.59 | TP53 (0.33) | TP53 | |
| SCHEMBL22167642 | 0.59 | FAAH (0.43) | FAAHCES1NCEH1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4093654-A | Production of pyridoxine intermediates from diketene | HOFFMANN-LA ROCHE INC. (US) | 1978-06-06 | — | — | US | disclosed |
| US-4026901-A | CATALYTIC DEHYDRATION; MOLECULAR SIEVE, SILICA, ALUMINA, OR PHOSPHORUS PENTOXIDE AS CATALYST | HOFFMANN-LA ROCHE INC. (US) | 1977-05-31 | — | — | US | disclosed |
| US-4026901-A | CATALYTIC DEHYDRATION; MOLECULAR SIEVE, SILICA, ALUMINA, OR PHOSPHORUS PENTOXIDE AS CATALYST | HOFFMANN-LA ROCHE INC. (US) | 1977-05-31 | — | — | US | disclosed |
| US-4026901-A | CATALYTIC DEHYDRATION; MOLECULAR SIEVE, SILICA, ALUMINA, OR PHOSPHORUS PENTOXIDE AS CATALYST | HOFFMANN-LA ROCHE INC. (US) | 1977-05-31 | — | — | US | disclosed |