Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 12/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TLR4 | O00206 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9485646 | 0.98 | BACE1 (0.33) | BACE1ALDH1A1LMNAMAPTOPRL1 | |
| SCHEMBL9486874 | 0.95 | CYP3A4 (0.35) | BACE1ALDH1A1LMNAMAPTOPRL1 | |
| SCHEMBL9485811 | 0.94 | KMT2A (0.34) | BACE1ALDH1A1LMNAMAPTOPRL1 | |
| SCHEMBL9486460 | 0.93 | CYP3A4 (0.35) | BACE1ALDH1A1LMNAMAPTOPRL1 | |
| SCHEMBL9486585 | 0.93 | CYP3A4 (0.35) | BACE1ALDH1A1LMNAMAPTOPRL1 | |
| SCHEMBL9194344 | 0.83 | RARB (0.42) | CYP2C9 | |
| SCHEMBL9194339 | 0.83 | RARB (0.42) | CYP2C9 | |
| SCHEMBL9842508 | 0.82 | TP53 (0.36) | MAPTHCAR2CYP2C9 | |
| SCHEMBL10345130 | 0.80 | RARB (0.45) | HCAR2CYP2C9 | |
| SCHEMBL10345131 | 0.80 | RARB (0.45) | HCAR2CYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5190692-A | FOUR RING ESTERS AND ETHERS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-03-02 | — | — | US | disclosed |