Known targets — ChEMBL curated mechanism
ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol
The experimentally established mechanism targets of Fumaric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A known ✓ | Q03164 | 2/20 | 0.34 |
| ▸ | HRH1 known ✓ | P35367 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | SLC16A3 | O15427 | 2/20 | 0.31 |
| ▸ | SLC16A1 | P53985 | 2/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL1300044 | 1.00 | ALDH1A1 (0.35) | ALDH1A1L3MBTL1KDM4EMEN1KMT2A | |
| SCHEMBL1298904 | 0.92 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1KDM4EMEN1KMT2A | |
| SCHEMBL5413798 | 0.78 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1KDM4EMEN1KMT2A | |
| SCHEMBL4115335 | 0.76 | ALDH1A1 (0.36) | ALDH1A1L3MBTL1KDM4EMEN1KMT2A | |
| SCHEMBL12107936 | 0.76 | ALDH1A1 (0.36) | ALDH1A1L3MBTL1KDM4EMEN1KMT2A | |
| SCHEMBL11340079 | 0.73 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1KDM4EMEN1KMT2A | |
| SCHEMBL8024385 | 0.72 | MAPT (0.46) | ALDH1A1L3MBTL1KDM4EMEN1KMT2A | |
| SCHEMBL4126480 | 0.72 | MAOB (0.40) | ALDH1A1L3MBTL1KDM4EMEN1KMT2A | |
| SCHEMBL1298937 | 0.71 | ALDH1A1 (0.53) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL14940641 | 0.71 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1KDM4EMEN1KMT2A |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7989501-B2 | Treating renal cancer using a 4-[bis[2-[(methylsulfonyl)oxy]ethyl]amino]-benzaldehyde | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2011-08-02 | — | — | US | claimed |
| US-20090131536-A1 | Treating or Preventing Renal Cancer Using a Dimethane Sulfonate | GOVERNMENT OF THE US, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2009-05-21 | — | — | US | claimed |
| WO-2007044015-A9 | TREATING OR PREVENTING RENAL CANCER USING A DIMETHANE SULFONATE | US GOV HEALTH & HUMAN SERV (US) | 2007-05-31 | — | — | WO | claimed |
| WO-2007044015-A1 | TREATING OR PREVENTING RENAL CANCER USING A DIMETHANE SULFONATE | GOVERNEMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2007-04-19 | — | — | WO | claimed |
| US-8273797-B2 | Treating renal cancer using 4-[bis[2-[(methylsulfonyl)oxy]ethyl]amino]-2-methyl-benzaldehyde | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2012-09-25 | — | — | US | disclosed |
| US-20110269840-A1 | TREATING RENAL CANCER USING A 4-[BIS[2-[(METHYLSULFONYL)OXY]ETHYL]AMINO]-2-METHYL-BENZALDEHYDE | HEALTH AND HUMAN SERVICES | 2011-11-03 | — | — | US | disclosed |
| US-7989501-B2 | Treating renal cancer using a 4-[bis[2-[(methylsulfonyl)oxy]ethyl]amino]-benzaldehyde | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2011-08-02 | — | — | US | disclosed |
| US-20090131536-A1 | Treating or Preventing Renal Cancer Using a Dimethane Sulfonate | GOVERNMENT OF THE US, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2009-05-21 | — | — | US | disclosed |
| WO-2007044015-A9 | TREATING OR PREVENTING RENAL CANCER USING A DIMETHANE SULFONATE | US GOV HEALTH & HUMAN SERV (US) | 2007-05-31 | — | — | WO | disclosed |
| WO-2007044015-A1 | TREATING OR PREVENTING RENAL CANCER USING A DIMETHANE SULFONATE | GOVERNEMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2007-04-19 | — | — | WO | 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 (2 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-20090131536-A1 | Treating or Preventing Renal Cancer Using a Dimethane Sulfonate | VHL, DDX21, MGMT | MEN1 288/4885KMT2A 73/4885HRH1 4685/4885 |
| US-20110269840-A1 | TREATING RENAL CANCER USING A 4-[BIS[2-[(METHYLSULFONYL)OXY]ETHYL]AMINO]-2-METHYL-BENZALDEHYDE | GLS, MGMT, KDM5B | MEN1 1667/4885KMT2A 39/4885HRH1 3460/4885 |
“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.