Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.46 |
| ▸ | TUBB | P07437 | 1/20 | 0.46 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.46 |
| ▸ | TUBA1B | P68363 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21275494 | 1.00 | CYP3A4 (0.49) | CYP3A4L3MBTL1CYP2D6CYP2C19MAOB | |
| SCHEMBL14178903 | 0.86 | CYP3A4 (0.63) | CYP3A4L3MBTL1MAOBHPGDSMN1; SMN2 | |
| SCHEMBL31643571 | 0.83 | MEN1 (0.59) | L3MBTL1MAOBHPGDSMN1; SMN2NPC1 | |
| SCHEMBL19267892 | 0.82 | MAOB (0.56) | CYP3A4L3MBTL1MAOBHPGDSMN1; SMN2 | |
| SCHEMBL21275479 | 0.81 | CYP3A4 (0.67) | CYP3A4CYP2D6CYP2C19MAOBHPGD | |
| SCHEMBL30002388 | 0.81 | CYP3A4 (0.67) | CYP3A4CYP2D6CYP2C19MAOBHPGD | |
| SCHEMBL31659371 | 0.81 | HPGD (0.54) | L3MBTL1MAOBHPGDSMN1; SMN2NPC1 | |
| SCHEMBL14178921 | 0.80 | MAOB (0.54) | CYP3A4L3MBTL1MAOBHPGDSMN1; SMN2 | |
| SCHEMBL25285427 | 0.79 | MAPT (0.78) | CYP3A4CYP2C19MAOBHPGDKMT2A | |
| SCHEMBL22490923 | 0.78 | MEN1 (0.54) | L3MBTL1MAOBHPGDSMN1; SMN2NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4322940-A1 | SYNTHETIC ROCAGLATES WITH BROAD-SPECTRUM ANTIVIRAL ACTIVITIES AND USES THEREOF | Memorial Sloan-Kettering Cancer Center (US) | 2024-02-21 | — | — | EP | disclosed |
| WO-2022221519-A1 | SYNTHETIC ROCAGLATES WITH BROAD-SPECTRUM ANTIVIRAL ACTIVITIES AND USES THEREOF | MEMORIAL SLOAN-KETTERING CANCER CENTER (US) | 2022-10-20 | — | — | WO | disclosed |