Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.30 |
| ▸ | CTSB | P07858 | 1/20 | 0.30 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3273262 | 0.86 | CTSL (0.34) | CTSLCTSBCTSK | |
| SCHEMBL23130548 | 0.81 | CTSL (0.38) | CTSLCTSBCTSK | |
| SCHEMBL17299362 | 0.81 | CTSL (0.30) | CTSLCTSBCTSK | |
| SCHEMBL22899073 | 0.80 | CTSL (0.32) | CTSLCTSBCTSK | |
| SCHEMBL14656297 | 0.77 | ACHE (0.30) | — | |
| SCHEMBL20458642 | 0.77 | CTSL (0.30) | CTSLCTSBCTSK | |
| SCHEMBL18467685 | 0.77 | CTSL (0.30) | CTSLCTSBCTSK | |
| SCHEMBL13088981 | 0.75 | — | — | |
| SCHEMBL23776739 | 0.75 | — | — | |
| SCHEMBL2336763 | 0.74 | CTSK (0.48) | CTSLCTSBCTSK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4032929-A1 | 1,3-BISISOCYANATOMETHYLCYCLOHEXANE COMPOSITION AND OPTICAL RESIN PREPARED THEREFROM | Wanhua Chemical Group Co., Ltd. (CN) | 2022-07-27 | — | — | EP | disclosed |
| WO-2021103550-A1 | 1,3-BISISOCYANATOMETHYLCYCLOHEXANE COMPOSITION AND OPTICAL RESIN PREPARED THEREFROM | 万华化学集团股份有限公司 | 2021-06-03 | — | — | WO | disclosed |
| US-10358523-B2 | Non-hot-melt MDI-based polyurethane composition bearing NCO end groups and having a low content of MDI monomer, comprising at least one isocyanate compound of particular molar volume | BOSTIK SA (FR) | 2019-07-23 | — | — | US | disclosed |