Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.31 |
| ▸ | DCK | P27707 | 1/20 | 0.30 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27409950 | 0.86 | ESR1 (0.41) | SMN1; SMN2IKBKBDCKESR1ESR2 | |
| SCHEMBL27409876 | 0.82 | NEK1 (0.34) | — | |
| SCHEMBL27253029 | 0.80 | SMN1; SMN2 (0.33) | SMN1; SMN2IKBKBDCKESR1ESR2 | |
| SCHEMBL224331 | 0.77 | GRIN2B (0.34) | SMN1; SMN2IKBKBFAAH | |
| SCHEMBL23733280 | 0.73 | KDM4E (0.44) | SMN1; SMN2IKBKBDCKALDH1A1HPGD | |
| SCHEMBL221784 | 0.73 | RARB (0.34) | SMN1; SMN2IKBKB | |
| SCHEMBL27253071 | 0.72 | ESR1 (0.42) | SMN1; SMN2IKBKBFAAHALDH1A1HPGD | |
| SCHEMBL19844719 | 0.72 | TAAR1 (0.40) | SMN1; SMN2FAAH | |
| SCHEMBL13614861 | 0.72 | TAAR1 (0.40) | SMN1; SMN2FAAH | |
| SCHEMBL27410165 | 0.72 | MCHR1 (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024133361-A1 | LIQUID-CRYSTAL MEDIUM | MERCK PATENT GMBH (DE) | 2024-06-27 | — | — | WO | disclosed |
| WO-2024133363-A1 | LIQUID-CRYSTAL MEDIUM | MERCK PATENT GMBH (DE) | 2024-06-27 | — | — | WO | disclosed |
| WO-2024126567-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2024-06-20 | — | — | WO | disclosed |