Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TLR4 | O00206 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HCAR1 | Q9BXC0 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 2/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4127785 | 0.78 | TLR4 (0.38) | MAPK1ALDH1A1TLR4LMNAHCAR1 | |
| SCHEMBL30792330 | 0.77 | TLR4 (0.39) | MAPK1MCL1ALDH1A1TLR4HCAR1 | |
| SCHEMBL15874730 | 0.74 | ALDH1A1 (0.46) | MCL1ALDH1A1LMNASMN1; SMN2MAPT | |
| SCHEMBL15874732 | 0.74 | ALDH1A1 (0.46) | MCL1ALDH1A1LMNASMN1; SMN2MAPT | |
| SCHEMBL15883574 | 0.73 | MAPK1 (0.44) | MAPK1MCL1ALDH1A1TLR4LMNA | |
| SCHEMBL27219385 | 0.73 | MAPK1 (0.44) | MAPK1MCL1ALDH1A1TLR4LMNA | |
| SCHEMBL9013833 | 0.72 | ALDH1A1 (0.36) | ALDH1A1TLR4LMNASMN1; SMN2HCAR1 | |
| SCHEMBL3438253 | 0.72 | DDB1 (0.50) | MCL1ALDH1A1TLR4SMN1; SMN2HCAR1 | |
| SCHEMBL31615356 | 0.71 | HCAR1 (0.41) | ALDH1A1TLR4LMNASMN1; SMN2HCAR1 | |
| Ethylene SCHEMBL27706119 | 0.69 | DDB1 (0.47) | MCL1ALDH1A1TLR4SMN1; SMN2HCAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0236754-B1 | NOVEL PROCESS FOR PREPARING 4-ACETYL ISOQUINOLINONE COMPOUNDS | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1990-08-29 | — | — | EP | claimed |
| CN-1007622-B | PROCESS FOR PREPARING 4-ACETYL-7 PYRIDYL-5,6,7,8-TETRAHYDRO-3(2H)-ISOQUINOLINONE COMPOUNDS | MITSUI TOATSU CHEMICALS (JP) | 1990-04-18 | — | — | CN | claimed |
| US-4814458-A | Process for preparing 4-acetyl isoquinolinone compounds | MITSUI TOATSU CHEMICALS, INC. (JP) | 1989-03-21 | — | — | US | claimed |
| EP-0236754-A1 | Novel process for preparing 4-acetyl isoquinolinone compounds | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1987-09-16 | — | — | EP | claimed |
| CN-87100838-A | The novel method of preparation 4-ethanoyl isoquinolines compound | — | 1987-09-09 | — | — | CN | claimed |
| JP-62187467-A | — | — | None | — | — | JP | disclosed |
| EP-0236754-B1 | NOVEL PROCESS FOR PREPARING 4-ACETYL ISOQUINOLINONE COMPOUNDS | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1990-08-29 | — | — | EP | disclosed |
| CN-1007622-B | PROCESS FOR PREPARING 4-ACETYL-7 PYRIDYL-5,6,7,8-TETRAHYDRO-3(2H)-ISOQUINOLINONE COMPOUNDS | MITSUI TOATSU CHEMICALS (JP) | 1990-04-18 | — | — | CN | disclosed |
| US-4814458-A | Process for preparing 4-acetyl isoquinolinone compounds | MITSUI TOATSU CHEMICALS, INC. (JP) | 1989-03-21 | — | — | US | disclosed |
| US-4814458-A | Process for preparing 4-acetyl isoquinolinone compounds | MITSUI TOATSU CHEMICALS, INC. (JP) | 1989-03-21 | — | — | US | disclosed |
| EP-0236754-A1 | Novel process for preparing 4-acetyl isoquinolinone compounds | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1987-09-16 | — | — | EP | disclosed |
| EP-0236754-A1 | Novel process for preparing 4-acetyl isoquinolinone compounds | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1987-09-16 | — | — | EP | disclosed |
| JP-S62187467-A | NOVEL PRODUCTION OF 4-ACETYLISOQUINOLINE COMPOUND | MITSUI TOATSU CHEM INC | 1987-08-15 | — | — | JP | disclosed |