Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | BACE1 | P56817 | 5/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | ESRRB | O95718 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | ESRRA | P11474 | 1/20 | 0.50 |
| ▸ | ESRRG | P62508 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
| ▸ | XPO1 | O14980 | 1/20 | 0.45 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24670882 | 1.00 | SMN1; SMN2 (0.53) | SMN1; SMN2KMT2AMEN1CYP2C19BACE1 | |
| SCHEMBL24670765 | 0.94 | KMT2A (0.60) | SMN1; SMN2KMT2AMEN1CYP2C19HTT | |
| SCHEMBL24670794 | 0.88 | SMN1; SMN2 (0.51) | SMN1; SMN2KMT2AMEN1CYP2C19BACE1 | |
| SCHEMBL29803695 | 0.88 | SMN1; SMN2 (0.51) | SMN1; SMN2KMT2AMEN1CYP2C19BACE1 | |
| SCHEMBL24670693 | 0.87 | MAPT (0.54) | SMN1; SMN2KMT2AMEN1CYP2C19BACE1 | |
| SCHEMBL29803595 | 0.87 | MAPT (0.54) | SMN1; SMN2KMT2AMEN1CYP2C19BACE1 | |
| SCHEMBL24670148 | 0.84 | SMN1; SMN2 (0.50) | SMN1; SMN2KMT2AMEN1CYP2C19HTT | |
| SCHEMBL2451687 | 0.84 | KMT2A (0.64) | SMN1; SMN2KMT2AMEN1CYP2C19HTT | |
| SCHEMBL24670268 | 0.84 | KMT2A (0.64) | SMN1; SMN2KMT2AMEN1CYP2C19HTT | |
| SCHEMBL5864036 | 0.84 | BACE1 (0.53) | SMN1; SMN2KMT2AMEN1CYP2C19BACE1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022192162-A1 | NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2022-09-15 | — | — | WO | disclosed |