Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL21927072 | 1.00 | AKR1B1 (0.32) | AKR1B1CYP19A1 | |
| SCHEMBL19309922 | 0.86 | AKR1B1 (0.33) | AKR1B1 | |
| SCHEMBL19310041 | 0.80 | — | — | |
| SCHEMBL21281328 | 0.78 | CYP19A1 (0.35) | CYP19A1 | |
| SCHEMBL19309913 | 0.77 | AKR1B1 (0.32) | AKR1B1CYP19A1 | |
| SCHEMBL22199360 | 0.72 | AKR1B1 (0.34) | AKR1B1CYP19A1 | |
| SCHEMBL21925221 | 0.71 | — | — | |
| SCHEMBL22199340 | 0.71 | — | — | |
| SCHEMBL21281401 | 0.69 | — | — | |
| SCHEMBL19310186 | 0.68 | AKR1B1 (0.33) | AKR1B1 |
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-3643709-A1 | ISOINDOLINE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF | Kangpu Biopharmaceuticals, Ltd. (CN) | 2020-04-29 | — | — | EP | disclosed |
| EP-3214081-A1 | ISOINDOLINE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF | Kangpu Biopharmaceuticals, Ltd. (CN) | 2017-09-06 | — | — | EP | disclosed |