Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25793259 | 0.79 | ALDH1A1 (0.49) | ALDH1A1LMNASMN1; SMN2CA1 | |
| SCHEMBL5319788 | 0.78 | ALDH1A1 (0.54) | SCDALDH1A1HDAC1HDAC3HDAC2 | |
| SCHEMBL23966661 | 0.77 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2MEN1GAA | |
| SCHEMBL892677 | 0.77 | SCD (0.48) | SCDALDH1A1HDAC1HDAC3HDAC6 | |
| SCHEMBL892659 | 0.77 | SCD (0.53) | SCDALDH1A1HDAC1HDAC3HDAC2 | |
| SCHEMBL2185599 | 0.75 | CNR2 (0.51) | SCDALDH1A1 | |
| SCHEMBL2185701 | 0.73 | ALDH1A1 (0.48) | SCDALDH1A1CYP17A1 | |
| SCHEMBL13391436 | 0.72 | ALDH1A1 (0.47) | SCDALDH1A1HDAC1HDAC3HDAC2 | |
| SCHEMBL18844361 | 0.70 | MAPT (0.50) | HDAC1HDAC3HDAC6HDAC10SMN1; SMN2 | |
| SCHEMBL9712888 | 0.70 | CYP1A2 (0.55) | ALDH1A1LMNASMN1; SMN2 |
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-2023288253-A1 | SMALL MOLECULES INHIBITORS OF CYCLIC GMP-AMP SYNTHASE (CGAS) | THE SCRIPPS RESEARCH INSTITUTE (US) | 2023-01-19 | — | — | WO | disclosed |