Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 3/20 | 0.44 |
| ▸ | CNR2 | P34972 | 3/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8517643 | 0.90 | CNR1 (0.47) | CNR1CNR2ESR1ESR2TSHR | |
| SCHEMBL7422495 | 0.82 | TSHR (0.52) | CNR1CNR2ESR1ESR2TSHR | |
| SCHEMBL8608504 | 0.80 | TSHR (0.50) | CNR1CNR2ESR1ESR2TSHR | |
| SCHEMBL21726601 | 0.77 | ALDH1A1 (0.52) | ESR1ESR2TSHRNR3C2SMN1; SMN2 | |
| SCHEMBL5305260 | 0.75 | TSHR (0.56) | TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1 | |
| SCHEMBL9766543 | 0.75 | TSHR (0.54) | TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1 | |
| SCHEMBL28360131 | 0.75 | TSHR (0.43) | TSHRSMN1; SMN2PTPN5PTPN1ALDH1A1 | |
| SCHEMBL28628323 | 0.73 | ALDH1A1 (0.43) | CNR1CNR2ESR1ESR2NR3C2 | |
| SCHEMBL8516948 | 0.73 | ALDH1A1 (0.38) | CNR1CNR2ESR1ESR2TSHR | |
| SCHEMBL8365847 | 0.72 | CNR1 (0.38) | CNR1CNR2ESR1ESR2TSHR |
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-0714785-B1 | Sulfonated phenol (salt) containing color-developing agents and color-developing sheets | MITSUI CHEMICALS INC (JP) | 1999-01-07 | — | — | EP | disclosed |
| US-5647896-A | MULTIVALENT SALT OF A SALICYLIC ACID DERIVATIVE, SULFONATED PHENOL | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-07-15 | — | — | US | disclosed |
| EP-0714785-A1 | Sulfonated phenol (salt) containing color-developing agents and color-developing sheets | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1996-06-05 | — | — | EP | disclosed |