Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | IDO1 | P14902 | 5/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19608948 | 0.85 | KDM4E (0.53) | CYP19A1ESR1POLBKDM4EMEN1 | |
| SCHEMBL30409436 | 0.85 | KDM4E (0.53) | CYP19A1ESR1POLBKDM4EMEN1 | |
| SCHEMBL30409248 | 0.83 | DAO (0.47) | POLBHSP90AA1HSP90AB1KDM4EMEN1 | |
| SCHEMBL30410032 | 0.80 | HPN (0.46) | ESR1POLBHSP90AA1KDM4EMEN1 | |
| SCHEMBL8653093 | 0.79 | POLB (0.53) | ESR1POLBHSP90AA1HSP90AB1MEN1 | |
| SCHEMBL5620225 | 0.79 | POLB (0.53) | ESR1POLBHSP90AA1HSP90AB1MEN1 | |
| SCHEMBL17422937 | 0.75 | CYP19A1 (0.71) | CYP19A1IDO1ESR1KDM4EMEN1 | |
| SCHEMBL11474936 | 0.75 | CYP19A1 (0.61) | CYP19A1IDO1ESR1POLBAR | |
| SCHEMBL8964895 | 0.73 | KDM4E (0.60) | CYP19A1ESR1POLBKDM4EMEN1 | |
| SCHEMBL17422783 | 0.73 | CYP19A1 (0.71) | CYP19A1IDO1ESR1CYP2A6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116102562-B | Naphtho [2,1-b ] indolo [2,3-d ] cyclooctalactone derivative and preparation method thereof | 江苏师范大学 | 2024-11-26 | — | — | CN | claimed |
| CN-116102562-A | Naphtho [2,1-b ] indolo [2,3-d ] cyclooctalactone derivative and preparation method thereof | 江苏师范大学 | 2023-05-12 | — | — | CN | claimed |
| CN-116102562-B | Naphtho [2,1-b ] indolo [2,3-d ] cyclooctalactone derivative and preparation method thereof | 江苏师范大学 | 2024-11-26 | — | — | CN | disclosed |
| CN-116102562-A | Naphtho [2,1-b ] indolo [2,3-d ] cyclooctalactone derivative and preparation method thereof | 江苏师范大学 | 2023-05-12 | — | — | CN | disclosed |