Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.61 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.58 |
| ▸ | CRBN | Q96SW2 | 5/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.49 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.49 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.49 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.49 |
| ▸ | KIF11 | P52732 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.46 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9379920 | 0.88 | CA9 (0.62) | SIRT2SMYD3CRBNNPC1MAPK13 | |
| SCHEMBL3307683 | 0.88 | KIF11 (0.61) | SIRT2SMYD3CRBNHDAC3HDAC4 | |
| SCHEMBL27599042 | 0.87 | CRBN (0.54) | SIRT2SMYD3CRBNHDAC3HDAC4 | |
| SCHEMBL3190474 | 0.85 | SMYD3 (0.57) | SIRT2SMYD3HDAC3 | |
| SCHEMBL939611 | 0.85 | SMYD3 (0.59) | SMYD3CRBNHDAC3HDAC4HDAC1 | |
| SCHEMBL29567045 | 0.85 | SMYD3 (0.57) | SIRT2SMYD3HDAC3 | |
| SCHEMBL29995492 | 0.85 | SMYD3 (0.59) | SMYD3CRBNHDAC3HDAC4HDAC1 | |
| SCHEMBL3312591 | 0.84 | TDP2 (0.60) | SIRT2SMYD3CRBNNPC1KIF11 | |
| Hydrochloric Acid SCHEMBL28849276 | 0.83 | SMYD3 (0.56) | SIRT2SMYD3HDAC3 | |
| Succinimide SCHEMBL9294241 | 0.83 | SMYD3 (0.58) | SMYD3CRBNHDAC3HDAC4HDAC1 |
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-2023122212-A2 | SUBSTITUTED PHENYL ETHYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS | SOUTHERN RESEARCH INSTITUTE (US) | 2023-06-29 | — | — | WO | disclosed |
| EP-0344634-B1 | Bicyclic carboxamides, process for their preparation and medicaments containing them | BOEHRINGER MANNHEIM GMBH (DE) | 1994-03-30 | — | — | EP | disclosed |
| US-5019587-A | Anticoagulants | BOEHRINGER MANNHEIM GMBH (DE) | 1991-05-28 | — | — | US | disclosed |
| EP-0344634-A1 | Bicyclic carboxamides, process for their preparation and medicaments containing them | Roche Diagnostics GmbH (DE) | 1989-12-06 | — | — | EP | disclosed |