Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | NQO1 | P15559 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | RXRB | P28702 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7848585 | 0.85 | KMT2A (0.50) | TP53CYP3A4LTA4HKDM4EMAPT | |
| SCHEMBL7848627 | 0.84 | TSHR (0.50) | CYP1A2CYP2C19LTA4HSMN1; SMN2THRB | |
| SCHEMBL7840499 | 0.82 | TSHR (0.57) | LTA4HTHRBTSHRKMT2A | |
| SCHEMBL7848088 | 0.81 | TSHR (0.59) | LTA4HTHRBTSHRKMT2A | |
| SCHEMBL3138349 | 0.81 | TP53 (0.53) | TP53CYP3A4NQO1MAPK1CYP1A2 | |
| SCHEMBL7851290 | 0.80 | TRIM24 (0.43) | MAPK1MAPTTSHRLMNAHPGD | |
| 1,3-Diethoxybenzene SCHEMBL1100167 | 0.79 | TP53 (0.71) | TP53CYP3A4NQO1MAPK1CYP1A2 | |
| SCHEMBL1794814 | 0.78 | ACHE (0.50) | CYP3A4ALDH1A1SMN1; SMN2RAB9A | |
| Bromide SCHEMBL38040 | 0.77 | SLC5A2 (0.47) | TP53NQO1CYP1A2CYP2D6CYP2C19 | |
| Bromide SCHEMBL1021629 | 0.76 | ACHE (0.48) | CYP3A4ALDH1A1SMN1; SMN2RAB9A |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0790251-B1 | Preparation and use of (3-alkoxyphenyl) magnesium chlorides | GRUENENTHAL GMBH (DE) | 2002-12-04 | — | — | EP | claimed |
| US-5852216-A | Preparation and use of (3-alkoxy-phenyl) magnesium chlorides | GRUENENTHAL GMBH (DE) | 1998-12-22 | — | — | US | claimed |
| EP-0790251-A2 | Preparation and use of (3-alkoxyphenyl) magnesium chlorides | Grünenthal GmbH (DE) | 1997-08-20 | — | — | EP | claimed |
| EP-0944611-B1 | DIMESYLATE SALTS OF NEUROPEPTIDE Y LIGANDS | PFIZER (US) | 2004-01-07 | — | — | EP | disclosed |
| EP-0790251-B1 | Preparation and use of (3-alkoxyphenyl) magnesium chlorides | GRUENENTHAL GMBH (DE) | 2002-12-04 | — | — | EP | disclosed |
| EP-0953564-B1 | Process for preparing 2-cyanobiphenyl compound | SUMIKA FINE CHEMICALS CO LTD (JP) | 2001-06-13 | — | — | EP | disclosed |
| EP-0854135-B1 | Process for preparing 2-cyanobiphenyl compound | SUMIKA FINE CHEMICALS CO LTD (JP) | 2000-02-02 | — | — | EP | disclosed |
| US-5998652-A | Process for preparing 2-cyanobiphenyl compound | SUMIKA FINE CHEMICALS CO., LTD. (JP) | 1999-12-07 | — | — | US | disclosed |
| EP-0953564-A1 | Process for preparing 2-cyanobiphenyl compound | SUMIKA FINE CHEMICALS Co., Ltd. (JP) | 1999-11-03 | — | — | EP | disclosed |
| EP-0944611-A1 | DIMESYLATE SALTS OF NEUROPEPTIDE Y LIGANDS | PFIZER INC. (US) | 1999-09-29 | — | — | EP | disclosed |
| US-5914329-A | TREATMENT OF CARDIOVASCULAR AND EATING DISORDERS | PFIZER INC. (US) | 1999-06-22 | — | — | US | disclosed |
| US-5852216-A | Preparation and use of (3-alkoxy-phenyl) magnesium chlorides | GRUENENTHAL GMBH (DE) | 1998-12-22 | — | — | US | disclosed |
| EP-0854135-A2 | Process for preparing 2-cyanobiphenyl compound | SUMIKA FINE CHEMICALS Co., Ltd. (JP) | 1998-07-22 | — | — | EP | disclosed |
| WO-1998023603-A1 | DIMESYLATE SALTS OF NEUROPEPTIDE Y LIGANDS | PFIZER INC. (US) | 1998-06-04 | — | — | WO | disclosed |
| EP-0790251-A2 | Preparation and use of (3-alkoxyphenyl) magnesium chlorides | Grünenthal GmbH (DE) | 1997-08-20 | — | — | EP | disclosed |