Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL122656 | 0.89 | ALDH1A1 (0.33) | ALDH1A1CYP3A4 | |
| Methacrylic Acid SCHEMBL5760793 | 0.76 | HSD11B1 (0.30) | — | |
| SCHEMBL30365261 | 0.76 | — | — | |
| SCHEMBL1070335 | 0.69 | ALDH1A1 (0.35) | ALDH1A1CYP3A4 | |
| SCHEMBL6030245 | 0.68 | — | — | |
| SCHEMBL4507437 | 0.64 | GRIN2D (0.41) | ALDH1A1CYP3A4 | |
| SCHEMBL6366117 | 0.62 | ALDH1A1 (0.33) | ALDH1A1CYP3A4 | |
| SCHEMBL22261614 | 0.62 | — | — | |
| SCHEMBL3718469 | 0.61 | GAA (0.39) | ALDH1A1CYP3A4 | |
| SCHEMBL17287307 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20030036620-A1 | From an aromatic isocyanate having a structure in which the isocyanate groups are not directly bonded to a benzene ring, an aliphatic isocyanate, an alicyclic isocyanate, and derivatives of these isocyanates. | MITSUI CHEMICALS, INC. (JP) | 2003-02-20 | — | — | US | disclosed |
| EP-1167416-A1 | URETHANE RESIN COMPOSITION FOR SEALING OPTOELECTRIC CONVERSION DEVICES | Mitsui Chemicals, Inc. (JP) | 2002-01-02 | — | — | EP | disclosed |