Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | GPR3 | P46089 | 3/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 4/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL26706119 | 0.89 | CES1 (0.44) | CES1CYP19A1GPR3 | |
| SCHEMBL30714800 | 0.81 | ACHE (0.56) | CYP19A1ACHE | |
| SCHEMBL3875408 | 0.81 | ACHE (0.56) | CYP19A1ACHE | |
| SCHEMBL26706270 | 0.78 | PARP1 (0.51) | — | |
| SCHEMBL6205297 | 0.77 | CES1 (0.47) | CES1CYP19A1GPR3BACE1LRRK2 | |
| SCHEMBL9180622 | 0.75 | ACHE (0.51) | CYP19A1ACHE | |
| SCHEMBL31660773 | 0.75 | PBRM1 (0.49) | CES1GPR3BACE1TRPV1LRRK2 | |
| SCHEMBL8126748 | 0.75 | PBRM1 (0.49) | CES1GPR3BACE1TRPV1LRRK2 | |
| SCHEMBL9136535 | 0.74 | CYP19A1 (0.41) | CYP19A1ACHE | |
| SCHEMBL7528414 | 0.74 | HSD17B10 (0.52) | CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4265613-A1 | BENZENE RING COMPOUND AND USE THEREOF | Nanjing Shijiang Medicine Technology Co., Ltd (CN) | 2023-10-25 | — | — | EP | disclosed |