Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | OGG1 | O15527 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL9816151 | 0.83 | TSHR (0.67) | TSHRMAPK1TDP1CYP19A1 | |
| SCHEMBL545084 | 0.83 | TSHR (0.67) | TSHRMAPK1TDP1CYP19A1 | |
| SCHEMBL4460794 | 0.81 | CYP2A6 (0.50) | TSHRCYP2A6CA2CA1CA5A | |
| SCHEMBL11231213 | 0.78 | TSHR (0.53) | TSHRMAPK1 | |
| SCHEMBL18548321 | 0.77 | CYP2A6 (0.44) | CYP2A6CA2CA1CA5ACA9 | |
| SCHEMBL9622508 | 0.77 | CYP2A6 (0.44) | TSHRCYP2A6CA2CA1CA5A | |
| SCHEMBL9876029 | 0.77 | CA1 (0.46) | TSHRCYP2A6CA2CA1CA5A | |
| SCHEMBL21791779 | 0.75 | CA1 (0.50) | TSHRCYP2A6CA2CA1CA5A | |
| SCHEMBL440244 | 0.73 | CYP2A6 (0.57) | TSHRCYP2A6CA2CA1CA5A | |
| SCHEMBL28912876 | 0.73 | CYP2A6 (0.57) | TSHRCYP2A6CA2CA1CA5A |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4163753-A | FROM AN ALIPHATIC ACID ANHYDRIDE AND A TRICHLOROMETHYL AROMATIC COMPOUND | Diaz Chemical Corporation (US) | 1979-08-07 | — | — | US | claimed |
| US-6313337-B1 | Method of making benzoyl halides and nitriles | OCCIDENTAL CHEMICAL CORPORATION | 2001-11-06 | — | — | US | disclosed |
| WO-2001079148-A2 | METHOD OF MAKING BENZOYL HALIDES AND NITRILES | AMERICAN WRECKING CORPORATION OF NEW JERSEY (US) | 2001-10-25 | — | — | WO | disclosed |
| US-4783562-A | Process for the preparation of trichloromethyl-substituted aromatic compounds, and trichloromethyl-substituted aromatic compounds obtained in this process | BAYER AKTIENGESELLSCHAFT (DE) | 1988-11-08 | — | — | US | disclosed |
| EP-0061029-B1 | PROCESS FOR THE PREPARATION OF TRICHLOROMETHYL-SUBSTITUTED AROMATIC COMPOUNDS | BAYER AG (DE) | 1986-01-08 | — | — | EP | disclosed |
| EP-0031436-B1 | A METHOD FOR THE CLEAVAGE OF SILOXANES | HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) | 1984-02-15 | — | — | EP | disclosed |
| US-4383116-A | Process for producing 4-benzoylpyrazoles | ISHIHARA SANGYO KAISHA LTD. (JP) | 1983-05-10 | — | — | US | disclosed |
| EP-0061029-A1 | Process for the preparation of trichloromethyl-substituted aromatic compounds | BAYER AG (DE) | 1982-09-29 | — | — | EP | disclosed |
| US-4310680-A | METAL OR METAL COMPOUND CATALYST | DYNAMIT NOBEL AG (DE) | 1982-01-12 | — | — | US | disclosed |
| EP-0031436-A2 | A method for the cleavage of siloxanes | HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) | 1981-07-08 | — | — | EP | disclosed |
| US-4220765-A | Process for the preparation of 4,6-dihalogeno-triazines | BAYER AKTIENGESELLSCHAFT (DE) | 1980-09-02 | — | — | US | disclosed |
| EP-0002493-B1 | PROCESS FOR THE PREPARATION OF 4,6-DIHALOGENO-1,3,5-TRIAZINES | BAYER AG (DE) | 1980-07-23 | — | — | EP | disclosed |
| US-4163753-A | FROM AN ALIPHATIC ACID ANHYDRIDE AND A TRICHLOROMETHYL AROMATIC COMPOUND | Diaz Chemical Corporation (US) | 1979-08-07 | — | — | US | disclosed |