Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dichloroacetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Dichloroacetic Acid SCHEMBL5307050 | 0.95 | LMNA (1.00) | — | |
| Dichloroacetic Acid SCHEMBL1331776 | 0.95 | — | — | |
| Dichloroacetic Acid SCHEMBL7777 | 0.95 | — | — | |
| Dichloroacetic Acid SCHEMBL6914108 | 0.91 | — | — | |
| Dichloroacetic Acid SCHEMBL8610684 | 0.91 | — | — | |
| Dichloroacetic Acid SCHEMBL9682664 | 0.91 | — | — | |
| Dichloroacetic Acid SCHEMBL3807223 | 0.91 | — | — | |
| Dichloroacetic Acid SCHEMBL6912684 | 0.91 | — | — | |
| Dichloroacetic Acid SCHEMBL6913523 | 0.91 | — | — | |
| Dichloroacetic Acid SCHEMBL7263077 | 0.91 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3895702-A1 | DERIVATIVE OF VALPROIC ACID AND DICHLOROACETATE USED FOR THE TREATMENT OF CANCER | Lietuvos Sveikatos Mokslu Universitetas (LT) | 2021-10-20 | — | — | EP | claimed |
| CN-113165888-B | Spherical forsterite particles, process for producing the same, and resin composition containing the same | 日产化学株式会社 | 2024-11-19 | — | — | CN | disclosed |
| US-12129360-B2 | Spherical forsterite particles, method for producing the same, and resin composition including spherical forsterite particles | NISSAN CHEMICAL CORPORATION (JP) | 2024-10-29 | — | — | US | disclosed |
| US-20220017724-A1 | SPHERICAL FORSTERITE PARTICLES, METHOD FOR PRODUCING THE SAME, AND RESIN COMPOSITION INCLUDING SPHERICAL FORSTERITE PARTICLES | NISSAN CHEMICAL CORPORATION (JP) | 2022-01-20 | — | — | US | disclosed |
| EP-3895702-A1 | DERIVATIVE OF VALPROIC ACID AND DICHLOROACETATE USED FOR THE TREATMENT OF CANCER | Lietuvos Sveikatos Mokslu Universitetas (LT) | 2021-10-20 | — | — | EP | disclosed |
| CN-113165888-A | Spherical forsterite particles, method for producing same, and resin composition containing spherical forsterite particles | 日产化学株式会社 | 2021-07-23 | — | — | CN | disclosed |
| CN-108366552-A | Compositions and methods for preserving tissue at ambient and sub-ambient temperatures | 哈佛学院董事会 | 2018-08-03 | — | — | CN | disclosed |