Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPBWR1 | P48145 | 10/20 | 0.45 |
| ▸ | PDE8B | O95263 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2185426 | 0.85 | NPBWR1 (0.50) | NPBWR1PDE8BMCHR1GLAGAA | |
| SCHEMBL16014455 | 0.80 | KMT2A (0.54) | NPBWR1PDE8BMCHR1GLAGAA | |
| SCHEMBL13791737 | 0.80 | NPBWR1 (0.45) | NPBWR1PDE8BMCHR1GLAGAA | |
| SCHEMBL2187321 | 0.79 | NPBWR1 (0.46) | NPBWR1MCHR1GLAGAAALDH1A1 | |
| SCHEMBL1801455 | 0.78 | NPBWR1 (0.54) | NPBWR1MCHR1GLAGAAKDM4E | |
| SCHEMBL1491119 | 0.76 | TSHR (0.67) | NPBWR1MCHR1GLAGAAKDM4E | |
| SCHEMBL16784437 | 0.75 | NPBWR1 (0.51) | NPBWR1MCHR1GLAGAAKDM4E | |
| SCHEMBL22632875 | 0.73 | NPBWR1 (0.52) | NPBWR1MCHR1GLAGAACYP1A2 | |
| SCHEMBL21796715 | 0.72 | NPBWR1 (0.51) | NPBWR1MCHR1GLAGAACYP1A2 | |
| SCHEMBL5653925 | 0.72 | NPBWR1 (0.51) | NPBWR1MCHR1GLAGAACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101538243-B | Malononitrile compounds and their use | SUMITOMO CHEMICAL CO | 2012-05-09 | — | — | CN | disclosed |
| CN-101544606-B | Malononitrile compound and use thereof | SUMITOMO CHEMICAL CO | 2012-02-29 | — | — | CN | disclosed |
| EP-1710234-B1 | MALONONITRILE COMPOUND AND USE THEREOF | SUMITOMO CHEMICAL CO (JP) | 2011-07-13 | — | — | EP | disclosed |
| EP-1710234-B1 | MALONONITRILE COMPOUND AND USE THEREOF | SUMITOMO CHEMICAL CO (JP) | 2011-07-13 | — | — | EP | disclosed |
| CN-1910147-B | Malononitrile compounds and their use | SUMITOMO CHEMICAL CO | 2011-04-20 | — | — | CN | disclosed |
| CN-101544606-A | Malononitrile compound and use thereof | SUMITOMO CHEMICAL CO | 2009-09-30 | — | — | CN | disclosed |
| CN-101538243-A | Malononitrile compound and use thereof | SUMITOMO CHEMICAL CO | 2009-09-23 | — | — | CN | disclosed |
| US-7541374-B2 | Malononitrile compounds and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-06-02 | — | — | US | disclosed |
| US-7541374-B2 | Malononitrile compounds and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-06-02 | — | — | US | disclosed |
| US-20070117854-A1 | Malononitrile compounds and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2007-05-24 | — | — | US | disclosed |
| US-20070117854-A1 | Malononitrile compounds and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2007-05-24 | — | — | US | disclosed |
| CN-1910147-A | Malononitrile compounds and their use | SUMITOMO CHEMICAL CO (JP) | 2007-02-07 | — | — | CN | disclosed |
| EP-1710234-A1 | MALONONITRILE COMPOUND AND USE THEREOF | Sumitomo Chemical Company, Limited (JP) | 2006-10-11 | — | — | EP | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20070117854-A1 | Malononitrile compounds and use thereof | ME1, DDT, CYP51A1 | NPBWR1 1661/4885PDE8B 4274/4885MCHR1 1106/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.