Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 3/20 | 0.48 |
| ▸ | EGFR | P00533 | 14/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7853572 | 0.91 | ERBB2 (0.44) | ERBB2EGFRKCNH2HPGDHTT | |
| SCHEMBL7853506 | 0.91 | EGFR (0.46) | ERBB2EGFRKCNH2HPGDHTT | |
| SCHEMBL7855912 | 0.90 | ERBB2 (0.45) | ERBB2EGFRKCNH2HPGDHTT | |
| SCHEMBL7853909 | 0.89 | EGFR (0.45) | ERBB2EGFRKCNH2HPGDHTT | |
| SCHEMBL7852464 | 0.89 | NOS1 (0.47) | ERBB2EGFRKCNH2HPGDHTT | |
| SCHEMBL7854005 | 0.89 | HPGD (0.46) | ERBB2EGFRKCNH2HPGDHTT | |
| SCHEMBL7851398 | 0.87 | EGFR (0.50) | ERBB2EGFRHTTMEN1MAPT | |
| SCHEMBL7697291 | 0.86 | S1PR1 (0.39) | ERBB2EGFRMEN1KMT2A | |
| SCHEMBL7584450 | 0.86 | ERBB2 (0.59) | ERBB2EGFRERBB4MEN1KMT2A | |
| SCHEMBL7852723 | 0.84 | EGFR (0.47) | ERBB2EGFRKCNH2HPGDHTT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2002539214-A | — | — | 2002-11-19 | — | — | JP | claimed |
| EP-1163242-A2 | BICYCLIC HETEROCYCLES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESSES FOR PREPARING THEM | Boehringer Ingelheim Pharma KG (DE) | 2001-12-19 | — | — | EP | claimed |
| WO-2000055162-A2 | BICYCLIC HETEROCYCLES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESSES FOR PREPARING THEM | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2000-09-21 | — | — | WO | claimed |
| EP-1163242-A2 | BICYCLIC HETEROCYCLES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESSES FOR PREPARING THEM | Boehringer Ingelheim Pharma KG (DE) | 2001-12-19 | — | — | EP | disclosed |
| WO-2000055162-A2 | BICYCLIC HETEROCYCLES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESSES FOR PREPARING THEM | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2000-09-21 | — | — | WO | disclosed |