Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 9/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 6/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL8912937 | 0.87 | NR1I2 (0.47) | NR1I2CYP3A4CYP2D6S1PR1S1PR3 | |
| SCHEMBL8558786 | 0.85 | NR1I2 (0.48) | NR1I2CYP3A4CYP2D6S1PR1S1PR3 | |
| SCHEMBL6976401 | 0.84 | NR1I2 (0.45) | NR1I2CYP3A4CYP2D6S1PR1S1PR3 | |
| SCHEMBL8691202 | 0.83 | NR1I2 (0.45) | NR1I2CYP3A4CYP2D6S1PR1S1PR3 | |
| SCHEMBL9087925 | 0.81 | NR1I2 (0.45) | NR1I2CYP3A4CYP2D6S1PR1S1PR3 | |
| SCHEMBL8913251 | 0.81 | NR1I2 (0.43) | NR1I2CYP3A4CYP2D6S1PR1S1PR3 | |
| SCHEMBL9089195 | 0.81 | NR1I2 (0.46) | NR1I2CYP3A4CYP2D6S1PR1S1PR3 | |
| SCHEMBL8132443 | 0.81 | NR1I2 (0.70) | NR1I2CYP3A4CYP2D6S1PR1S1PR3 | |
| SCHEMBL8553621 | 0.81 | NR1I2 (0.44) | NR1I2CYP3A4CYP2D6S1PR1S1PR3 | |
| SCHEMBL9089929 | 0.80 | NR1I2 (0.45) | NR1I2CYP3A4CYP2D6S1PR1S1PR3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0759755-B1 | Thiadiazolylalkoxyphenyl derivatives, their preparation and their use anti-picornaviral agents | SANOFI SYNTHELABO (FR) | 2003-08-13 | — | — | EP | disclosed |
| US-5650419-A | Thiadiazoles and their use as antipicornaviral agents | SANOFI, S.A. | 1997-07-22 | — | — | US | disclosed |
| US-5567719-A | Thiadiazoles and their use as antipicornaviral agents | STERLING WINTHROP, INC. (US) | 1996-10-22 | — | — | US | disclosed |
| US-5453433-A | Viricides; antiseptics to decontaminate polio, rhino and coxsackie viruses | STERLING WINTHROP INC. (US) | 1995-09-26 | — | — | US | disclosed |