Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4421226 | 0.84 | TP53 (0.45) | DEGS1MAPTMEN1KMT2AGAA | |
| SCHEMBL11415801 | 0.83 | CYP19A1 (0.43) | CYP19A1MAPTMEN1KMT2AGAA | |
| SCHEMBL17058997 | 0.82 | CYP19A1 (0.42) | CYP19A1MAPTMEN1KMT2AGAA | |
| SCHEMBL13401912 | 0.82 | CYP19A1 (0.42) | CYP19A1MAPTMEN1KMT2AGAA | |
| SCHEMBL10313721 | 0.82 | DEGS1 (0.39) | CYP19A1DEGS1MAPTGAA | |
| SCHEMBL18937660 | 0.81 | CYP19A1 (0.33) | CYP19A1DEGS1 | |
| SCHEMBL18937453 | 0.81 | CYP19A1 (0.33) | CYP19A1DEGS1 | |
| SCHEMBL178342 | 0.81 | CYP19A1 (0.33) | CYP19A1DEGS1 | |
| SCHEMBL16203169 | 0.81 | CYP19A1 (0.41) | CYP19A1MAPTMEN1KMT2AGAA | |
| SCHEMBL4396795 | 0.80 | ALDH1A1 (0.44) | CYP19A1MEN1KMT2A |
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-3354709-A1 | COMPOUNDS AND LIQUID CRYSTALLINE MEDIUM | Merck Patent GmbH (DE) | 2018-08-01 | — | — | EP | disclosed |
| EP-3354710-A1 | COMPOUNDS AND LIQUID CRYSTALLINE MEDIUM | Merck Patent GmbH (DE) | 2018-08-01 | — | — | EP | disclosed |