Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.48 |
| ▸ | HPGD | P15428 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | CASP1 | P29466 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9766142 | 0.79 | KEAP1 (0.39) | TSHRHPGDHSD17B10CYP3A4HSP90AA1 | |
| SCHEMBL1437003 | 0.78 | CYP3A4 (0.48) | TSHRHPGDHSD17B10CYP3A4HSP90AA1 | |
| SCHEMBL1315659 | 0.78 | CYP3A4 (0.48) | TSHRHPGDHSD17B10CYP3A4HSP90AA1 | |
| SCHEMBL8647557 | 0.76 | CYP3A4 (0.46) | TSHRHPGDHSD17B10CYP3A4HSP90AA1 | |
| SCHEMBL10498598 | 0.76 | CYP3A4 (0.46) | TSHRHPGDHSD17B10CYP3A4HSP90AA1 | |
| Fluoride SCHEMBL6445648 | 0.76 | CYP3A4 (0.47) | TSHRHPGDHSD17B10CYP3A4HSP90AA1 | |
| SCHEMBL11406014 | 0.74 | CYP3A4 (0.43) | TSHRHPGDHSD17B10CYP3A4HSP90AA1 | |
| SCHEMBL5591588 | 0.74 | MEN1 (0.37) | TSHRHPGDHSD17B10CYP3A4HSP90AA1 | |
| SCHEMBL20577112 | 0.74 | CYP3A4 (0.43) | TSHRHPGDHSD17B10CYP3A4HSP90AA1 | |
| SCHEMBL11704506 | 0.74 | CYP3A4 (0.43) | TSHRHPGDHSD17B10CYP3A4HSP90AA1 |
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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5565614-A | FLUORINATION | BAYER AKTIENGESELLSCHAFT (DE) | 1996-10-15 | — | — | US | claimed |
| US-5362909-A | Two stage fluorination | BAYER AKTIENGESELLSCHAFT (DE) | 1994-11-08 | — | — | US | claimed |
| EP-0164619-B1 | 2,4,5-TRIHALO OR 2,3,4,5-TETRAHALO BENZENE DERIVATIVES AND PROCESS FOR PRODUCING THEM | BAYER AG (DE) | 1988-10-12 | — | — | EP | claimed |
| CN-85101737-A | Preparation 2,4,5-trihalogenated benzene and 2,3,4, the derivative method of 5-tetrahalogeno-benzene | — | 1987-01-31 | — | — | CN | claimed |
| EP-0164619-A1 | 2,4,5-Trihalo or 2,3,4,5-tetrahalo benzene derivatives and process for producing them | BAYER AG (DE) | 1985-12-18 | — | — | EP | claimed |
| EP-1233010-B1 | Method for production of organic fluorine compound | NIPPON CATALYTIC CHEM IND (JP) | 2005-06-15 | — | — | EP | disclosed |
| EP-0908438-B1 | Process for the preparation of 2,3,4,5-tetrafluorobenzene derivatives | BAYER AG (DE) | 2003-11-26 | — | — | EP | disclosed |
| US-6613948-B1 | Reacting the corresponding chlorobenzene or (chloro, fluoro)-benzene derivatives with potassium fluoride in solvent; distillation; tetrachloro benzotrifluoride, -benzoyl fluoride, or -benzonitrile as starting materials | BAYER AG (DE) | 2003-09-02 | — | — | US | disclosed |
| EP-0899256-B1 | Method for production of organic fluorine compound | NIPPON CATALYTIC CHEM IND (JP) | 2003-08-06 | — | — | EP | disclosed |
| EP-1233010-A1 | Method for production of organic fluorine compound | Nippon Shokubai Co., Ltd. (JP) | 2002-08-21 | — | — | EP | disclosed |
| US-6392084-B1 | FLUORINATION OF AN ORGANO(BROMINE OR CHLORIDE) COMPOUND IN BENZONITRILE SOLVENT | NIPPON SHOKUBAI CO., LTD. (JP) | 2002-05-21 | — | — | US | disclosed |
| US-6114590-A | Process for the preparation of polyhalogenated benzotrifluorides, benzotrichlorides and benzoyl chlorides and new trihalogenobenzotrichlorides and -benzoyl chlorides | BAYER AKTIENGESELLSCHAFT (DE) | 2000-09-05 | — | — | US | disclosed |
| US-5362909-A | Two stage fluorination | BAYER AKTIENGESELLSCHAFT (DE) | 1994-11-08 | — | — | US | disclosed |
| EP-0607824-A2 | Method for the production of multiply halogenated benzotrifluorides, benzotrichlorides and benzoyl chlorides as well as trihalobenzotrichlorides and -benzoyl chlorides | BAYER AG (DE) | 1994-07-27 | — | — | EP | disclosed |
| US-5200548-A | Intermediates for bactericides | BAYER AKTIENGESELLSCHAFT (DE) | 1993-04-06 | — | — | US | disclosed |
| US-5072038-A | Chemical intermediates for bactericides | BAYER AKTIENGESELLSCHAFT (DE) | 1991-12-10 | — | — | US | disclosed |
| CN-1013370-B | Process for preparing derivatives of 2, 4, 5-trihalobenzenes and 2, 3, 4, 5-tetrahalobenzenes | BAYER AG (DE) | 1991-07-31 | — | — | CN | disclosed |
| EP-0164619-B1 | 2,4,5-TRIHALO OR 2,3,4,5-TETRAHALO BENZENE DERIVATIVES AND PROCESS FOR PRODUCING THEM | BAYER AG (DE) | 1988-10-12 | — | — | EP | disclosed |
| CN-85101737-A | Preparation 2,4,5-trihalogenated benzene and 2,3,4, the derivative method of 5-tetrahalogeno-benzene | — | 1987-01-31 | — | — | CN | disclosed |
| EP-0164619-A1 | 2,4,5-Trihalo or 2,3,4,5-tetrahalo benzene derivatives and process for producing them | BAYER AG (DE) | 1985-12-18 | — | — | EP | disclosed |