Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.35 |
| ▸ | SLC34A1 | Q06495 | 2/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30130322 | 1.00 | CYP1A2 (0.39) | CYP1A2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL8549829 | 0.88 | GAA (0.37) | CYP1A2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL8570221 | 0.86 | MEN1 (0.37) | CYP1A2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL8566222 | 0.85 | MEN1 (0.38) | CYP1A2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL7615238 | 0.84 | MEN1 (0.36) | CYP1A2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL27322874 | 0.84 | MEN1 (0.36) | CYP1A2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL8564686 | 0.84 | MEN1 (0.36) | CYP1A2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL6289041 | 0.84 | MEN1 (0.36) | CYP1A2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL5398257 | 0.82 | CYP1A2 (0.35) | CYP1A2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL7591106 | 0.81 | MEN1 (0.34) | CYP1A2CYP2C19MEN1CYP2C9KMT2A |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0553307-B1 | HERBICIDAL SUBSTITUTED ARYL-HALOALKYLPYRAZOLES | MONSANTO CO (US) | 1998-12-09 | — | — | EP | claimed |
| EP-0772598-B1 | PREPARATION OF HETEROCYCLIC- AND CARBOCYCLIC-SUBSTITUTED BENZOIC ACIDS | MONSANTO TECHNOLOGY LLC (US) | 2002-02-06 | — | — | EP | disclosed |
| CN-1050121-C | Process for preparing substituted aryl-halogenoalkyl pyrazoles | MONSANTO CO (US) | 2000-03-08 | — | — | CN | disclosed |
| EP-0553307-B1 | HERBICIDAL SUBSTITUTED ARYL-HALOALKYLPYRAZOLES | MONSANTO CO (US) | 1998-12-09 | — | — | EP | disclosed |
| EP-0791571-A1 | Benzoyl derivatives | MONSANTO COMPANY (US) | 1997-08-27 | — | — | EP | disclosed |
| EP-0772598-A1 | HETEROCYCLIC- AND CARBOCYCLIC-SUBSTITUTED BENZOIC ACIDS AND SYNTHESIS THEREOF | MONSANTO COMPANY (US) | 1997-05-14 | — | — | EP | disclosed |
| US-5587485-A | CATALYTIC OXIDATION OF THE CORRESPONDING ALKYL SUBSTITUTED BENZENE COMPOUND | MONSANTO COMPANY (US) | 1996-12-24 | — | — | US | disclosed |
| US-5536700-A | Herbicidal compositions comprising aryl-5-haloalkylpyrazoles and glyphosate, it's salts, diquat or paraquat | MONSANTO COMPANY (US) | 1996-07-16 | — | — | US | disclosed |
| US-5530126-A | ALKYLATION IN INERT SOLVENT | MONSANTO COMPANY (US) | 1996-06-25 | — | — | US | disclosed |
| US-5496956-A | BY ESTERIFICATION OF CARBOXY SUBSTITUTION WITH ALCOHOLS IN THE PRESENCE OF MINERAL ACID | MONSANTO COMPANY (US) | 1996-03-05 | — | — | US | disclosed |
| US-5489571-A | CROP-SAFE COMPOUNDS EFFECTIVE AT LOW CONCENTRATIONS | MONSANTO COMPANY (US) | 1996-02-06 | — | — | US | disclosed |
| WO-1996002515-A1 | HETEROCYCLIC- AND CARBOCYCLIC-SUBSTITUTED BENZOIC ACIDS AND SYNTHESIS THEREOF | MONSANTO COMPANY (US) | 1996-02-01 | — | — | WO | disclosed |
| CN-1030595-C | Substituted aryl-haloalkyl-pyrazoles as herbicides | MONSANTO CO (US) | 1996-01-03 | — | — | CN | disclosed |
| CN-1090845-A | Process for preparing substituted aryl-halogenoalkyl pyrazoles | MONSANTO CO (US) | 1994-08-17 | — | — | CN | disclosed |
| US-5281571-A | Herbicidal benzoxazinone- and benzothiazinone-substituted pyrazoles | MONSANTO COMPANY (US) | 1994-01-25 | — | — | US | disclosed |
| EP-0553307-A1 | HERBICIDAL SUBSTITUTED ARYL-HALOALKYLPYRAZOLES | MONSANTO COMPANY (US) | 1993-08-04 | — | — | EP | disclosed |
| CN-1061777-A | Substituted aryl-haloalkyl-pyrazoles as herbicides | MONSANTO CO (US) | 1992-06-10 | — | — | CN | disclosed |
| WO-1992006962-A1 | HERBICIDAL SUBSTITUTED ARYL-HALOALKYLPYRAZOLES | MONSANTO COMPANY (US) | 1992-04-30 | — | — | WO | disclosed |