Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | CTSC | P53634 | 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 | |
|---|---|---|---|---|
| SCHEMBL24300945 | 0.98 | ESR1 (0.31) | ESR1ESR2CTSKCTSC | |
| SCHEMBL24300959 | 0.95 | ESR1 (0.32) | ESR1ESR2CTSKCTSC | |
| SCHEMBL27027388 | 0.91 | CTSK (0.34) | ESR1ESR2CTSKCTSC | |
| SCHEMBL24300866 | 0.89 | RARB (0.33) | — | |
| SCHEMBL24300966 | 0.89 | AAK1 (0.31) | CTSKCTSC | |
| SCHEMBL24300944 | 0.88 | ESR1 (0.35) | ESR1ESR2 | |
| SCHEMBL27410172 | 0.87 | MCHR1 (0.31) | CTSKCTSC | |
| SCHEMBL24300864 | 0.86 | RARB (0.34) | ESR1ESR2 | |
| SCHEMBL24300968 | 0.86 | — | — | |
| SCHEMBL27027386 | 0.86 | CTSK (0.35) | ESR1ESR2CTSKCTSC |
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-2024126567-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2024-06-20 | — | — | WO | disclosed |