Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 8/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 9/20 | 0.51 |
| ▸ | RAB9A | P51151 | 8/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.50 |
| ▸ | RELA | Q04206 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18608950 | 0.86 | HDAC4 (0.67) | HDAC4HDAC6HDAC1NPC1RAB9A | |
| SCHEMBL4227737 | 0.86 | NR1H4 (0.56) | HDAC4HDAC6HDAC1NR1H4NPC1 | |
| SCHEMBL7019255 | 0.85 | NR1H4 (0.54) | HDAC4HDAC6HDAC1NR1H4NPC1 | |
| SCHEMBL22530424 | 0.82 | HDAC6 (0.51) | HDAC4HDAC6HDAC1 | |
| SCHEMBL29571732 | 0.82 | HDAC4 (0.50) | HDAC4HDAC6HDAC1 | |
| SCHEMBL29390471 | 0.81 | HDAC4 (0.57) | HDAC4HDAC6HDAC1 | |
| SCHEMBL31375602 | 0.81 | NPC1 (0.54) | HDAC4HDAC6HDAC1NR1H4NPC1 | |
| SCHEMBL22531063 | 0.81 | HDAC6 (0.51) | HDAC4HDAC6HDAC1ALDH1A1 | |
| SCHEMBL29974996 | 0.80 | HDAC6 (0.48) | HDAC4HDAC6HDAC1 | |
| SCHEMBL29966809 | 0.80 | HDAC6 (0.53) | HDAC4HDAC6HDAC1 |
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-2024068520-A1 | 3-(HETERO)ARYL-5-CHLORODIFLUOROMETHYL-1,2,4-OXADIAZOLE AS FUNGICIDE | BAYER AKTIENGESELLSCHAFT (DE) | 2024-04-04 | — | — | WO | disclosed |
| EP-4295688-A1 | ACTIVE COMPOUND COMBINATION | Bayer Aktiengesellschaft (DE) | 2023-12-27 | — | — | EP | disclosed |
| WO-2022207494-A1 | 3-(HETERO)ARYL-5-CHLORODIFLUOROMETHYL-1,2,4-OXADIAZOLE AS FUNGICIDE | BAYER AKTIENGESELLSCHAFT (DE) | 2022-10-06 | — | — | WO | disclosed |
| WO-2022207496-A1 | 3-(HETERO)ARYL-5-CHLORODIFLUOROMETHYL-1,2,4-OXADIAZOLE AS FUNGICIDE | BAYER AKTIENGESELLSCHAFT (DE) | 2022-10-06 | — | — | WO | disclosed |