Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SCD5 | Q86SK9 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | PIK3C3 | Q8NEB9 | 2/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14829350 | 0.82 | BACE1 (0.39) | BACE1TSHRATMRIPK1SCD5 | |
| SCHEMBL3841905 | 0.78 | RIPK1 (0.49) | RIPK1SCD5LMNAHPGDALDH1A1 | |
| SCHEMBL12944620 | 0.78 | BACE1 (0.51) | BACE1TSHRATMRIPK1MAPK1 | |
| SCHEMBL8030548 | 0.77 | PARP14 (0.46) | RIPK1HPGDALDH1A1 | |
| SCHEMBL14095299 | 0.75 | BACE1 (0.49) | BACE1TSHRATMRIPK1MAPK1 | |
| SCHEMBL27364822 | 0.74 | BACE1 (0.53) | BACE1TSHRATMRIPK1MAPK1 | |
| SCHEMBL14829587 | 0.74 | BACE1 (0.53) | BACE1TSHRATMRIPK1MAPK1 | |
| SCHEMBL14829651 | 0.74 | ALDH1A1 (0.41) | LMNAHTTSMN1; SMN2HPGDALDH1A1 | |
| SCHEMBL21223180 | 0.72 | BACE1 (0.51) | BACE1TSHRATMRIPK1MAPK1 | |
| SCHEMBL21223183 | 0.72 | BACE1 (0.51) | BACE1TSHRATMRIPK1MAPK1 |
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-1318977-A1 | SUBSTITUTED PHENYLCYCLOHEXANE CARBOXYLIC ACID AMIDES AND THE USE THEREOF | Bayer Aktiengesellschaft (DE) | 2003-06-18 | — | — | EP | disclosed |
| WO-2002020472-A1 | SUBSTITUTED PHENYLCYCLOHEXANE CARBOXYLIC ACID AMIDES AND THE USE THEREOF | BAYER AKTIENGESELLSCHAFT (DE) | 2002-03-14 | — | — | WO | disclosed |