Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.30 |
| ▸ | GRIK2 | Q13002 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9577142 | 1.00 | TSHR (0.39) | TSHRCYP3A4CYP2C19CA1CA2 | |
| SCHEMBL28731962 | 0.88 | USP2 (0.35) | TSHRCYP3A4CYP2C19CA1CA2 | |
| SCHEMBL5868355 | 0.87 | TSHR (0.38) | TSHRCYP3A4CYP2C19 | |
| SCHEMBL28961040 | 0.87 | CYP3A4 (0.38) | TSHRCYP3A4CYP2C19 | |
| SCHEMBL347521 | 0.86 | — | — | |
| SCHEMBL6851758 | 0.85 | — | — | |
| SCHEMBL8750893 | 0.85 | — | — | |
| SCHEMBL5716954 | 0.85 | — | — | |
| SCHEMBL636719 | 0.85 | — | — | |
| SCHEMBL28895135 | 0.84 | TSHR (0.37) | TSHRCYP3A4CYP2C19 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5266703-A | Optically active isoxazole derivatives | DAISO CO., LTD. (JP) | 1993-11-30 | — | — | US | disclosed |
| US-5220074-A | Optically active isoxazole derivatives and intermediates for preparation thereof as well as processes for producing the same | DAISO CO., LTD. (JP) | 1993-06-15 | — | — | US | disclosed |
| US-5210201-A | Optically active isoxazole derivatives and intermediates for preparation thereof as well as processes for producing the same | DAISO CO., LTD. (JP) | 1993-05-11 | — | — | US | disclosed |
| US-5198588-A | OPTICALLY ACTIVE ISOXAZOLE DERIVATIVES AND INTERMEDIATES FOR PREPARATION THEREOF | DAISO CO., LTD. (JP) | 1993-03-30 | — | — | US | disclosed |
| EP-0439129-A2 | Optically active isoxazole derivatives and intermediates for preparation thereof as well as processes for producing the same | Daiso Co., Ltd. (JP) | 1991-07-31 | — | — | EP | disclosed |