Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.51 |
| ▸ | MAOA | P21397 | 4/20 | 0.51 |
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL508402 | 0.80 | CYP2A6 (0.52) | MAOBMAOAIDO1HTTLOXL2 | |
| SCHEMBL5697547 | 0.78 | DAO (0.46) | HTTL3MBTL1KIF11MAPTDAO | |
| SCHEMBL4597178 | 0.76 | HTT (0.66) | MAOBMAOAIDO1HTTLOXL2 | |
| SCHEMBL28180117 | 0.76 | IDO1 (0.59) | MAOBMAOAIDO1HTTLOXL2 | |
| SCHEMBL16176368 | 0.74 | KIF11 (0.62) | MAOBMAOAIDO1HTTKIF11 | |
| SCHEMBL3890051 | 0.72 | LOXL2 (0.52) | MAOBMAOAIDO1HTTLOXL2 | |
| SCHEMBL22190286 | 0.72 | APP (0.39) | IDO1DAO | |
| SCHEMBL22211000 | 0.72 | IDO1 (0.55) | MAOBMAOAIDO1HTTLOXL2 | |
| SCHEMBL22190294 | 0.72 | IDO1 (0.45) | MAOBIDO1CYP2A6 | |
| SCHEMBL3355345 | 0.72 | IDO1 (0.45) | IDO1HTTCYP2A6BCHEACHE |
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-6225505-B1 | BY REACTING BENZYL HALIDE DERIVATIVE WITH THIOPHOSGENE AND POTASSIUM FLUORIDE IN ACETONITRILE; HIGH YIELD AND PURITY WITHOUT USING OZONE LAYER-DESTROYING SUBSTANCE; USE AS INTERMEDIATE FOR DRUGS AND AGROCHEMICALS | IHARA CHEMICAL INDUSTRY CO., LTD (JP) | 2001-05-01 | — | — | US | claimed |
| EP-1000933-A1 | TRIFLUORO METHYLTHIOMETHYL BENZENE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME | Ihara Chemical Industry Co., Ltd. (JP) | 2000-05-17 | — | — | EP | claimed |
| EP-1000933-B1 | TRIFLUORO METHYLTHIOMETHYL BENZENE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME | IHARA CHEMICAL IND CO (JP) | 2006-08-02 | — | — | EP | disclosed |
| US-6225505-B1 | BY REACTING BENZYL HALIDE DERIVATIVE WITH THIOPHOSGENE AND POTASSIUM FLUORIDE IN ACETONITRILE; HIGH YIELD AND PURITY WITHOUT USING OZONE LAYER-DESTROYING SUBSTANCE; USE AS INTERMEDIATE FOR DRUGS AND AGROCHEMICALS | IHARA CHEMICAL INDUSTRY CO., LTD (JP) | 2001-05-01 | — | — | US | disclosed |
| EP-1000933-A1 | TRIFLUORO METHYLTHIOMETHYL BENZENE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME | Ihara Chemical Industry Co., Ltd. (JP) | 2000-05-17 | — | — | EP | disclosed |