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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.38 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | ALPL | P05186 | 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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL21436329 | 0.85 | ALPL (0.33) | ALPL | |
| Acetic Acid SCHEMBL1871815 | 0.85 | ALPL (0.33) | ALPL | |
| Succinic Acid SCHEMBL21436621 | 0.79 | EGLN1 (0.38) | EGLN1LMNACYP2C9ALPL | |
| Pivalate SCHEMBL28053669 | 0.79 | ALPL (0.30) | ALDH1A1ALPL | |
| SCHEMBL64209 | 0.79 | — | — | |
| Cadaverine Tartrate SCHEMBL21436357 | 0.78 | TSHR (0.40) | TSHR | |
| Hydrochloric Acid SCHEMBL3832428 | 0.77 | ALPL (0.40) | ALPL | |
| Hydrochloric Acid SCHEMBL14335493 | 0.77 | — | — | |
| Ammonia Solution, Strong SCHEMBL21436559 | 0.77 | — | — | |
| Methylamine SCHEMBL27813413 | 0.74 | ALPL (0.39) | ALPL |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210147366-A1 | PROCESS FOR PREPARATION OF 2,2-DIMETHYLPIPERAZINE | H. LUNDBECK A/S (DK) | 2021-05-20 | — | — | US | disclosed |
| EP-3774742-A1 | PROCESS FOR THE PREPARATION OF 2,2-DIMETHYLPIPERAZINE | H. Lundbeck A/S (DK) | 2021-02-17 | — | — | EP | disclosed |
| CN-111868041-A | Process for the preparation of 2, 2-dimethylpiperazine | H.隆德贝克有限公司 | 2020-10-30 | — | — | CN | disclosed |
| WO-2019193134-A1 | PROCESS FOR THE PREPARATION OF 2,2-DIMETHYLPIPERAZINE | H. LUNDBECK A/S (DK) | 2019-10-10 | — | — | 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 (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-20210147366-A1 | PROCESS FOR PREPARATION OF 2,2-DIMETHYLPIPERAZINE | CYP4F12, CYP4F2, CYP4F3 | TSHR 910/4885TP53 1925/4885EGLN1 2080/4885 |
“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.