Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LDHA | P00338 | 3/20 | 0.40 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.39 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.39 |
| ▸ | LDHB | P07195 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL9711543 | 0.80 | LDHA (0.44) | ALDH1A1LDHASIRT2SIRT1LDHB | |
| SCHEMBL29009153 | 0.72 | CYP2D6 (0.44) | ALDH1A1POLBSLC6A3 | |
| SCHEMBL11578414 | 0.71 | SIRT2 (0.45) | ALDH1A1SIRT2SIRT1CES2CES1 | |
| SCHEMBL14140168 | 0.69 | KMT2A (0.39) | ALDH1A1LDHASMN1; SMN2MAPT | |
| SCHEMBL14139801 | 0.69 | KMT2A (0.39) | ALDH1A1LDHASMN1; SMN2MAPT | |
| SCHEMBL29294925 | 0.69 | KMT2A (0.39) | ALDH1A1LDHASMN1; SMN2MAPT | |
| SCHEMBL2949431 | 0.69 | MAOB (0.42) | SLC6A3SMN1; SMN2MAPT | |
| SCHEMBL20213620 | 0.69 | KMT2A (0.39) | ALDH1A1LDHASMN1; SMN2MAPT | |
| SCHEMBL9711615 | 0.69 | LDHA (0.42) | ALDH1A1LDHALDHBSLC6A3SMN1; SMN2 | |
| SCHEMBL9711476 | 0.69 | LDHA (0.44) | ALDH1A1LDHALDHBSLC6A3SMN1; SMN2 |
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-1080072-A1 | 2-(2-CHLOROPHENYL)-3,4-DIHYDRO-2H-PYRROL DERIVATIVES | Bayer Aktiengesellschaft (DE) | 2001-03-07 | — | — | EP | disclosed |
| WO-1999059968-A1 | 2-(2-CHLOROPHENYL)-3,4-DIHYDRO-2H-PYRROL DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 1999-11-25 | — | — | WO | disclosed |