Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. 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 | |
|---|---|---|---|---|
| SCHEMBL155993 | 0.89 | — | — | |
| SCHEMBL6828919 | 0.80 | — | — | |
| Water SCHEMBL10491269 | 0.80 | — | — | |
| SCHEMBL8823329 | 0.80 | MAPK1 (0.50) | — | |
| SCHEMBL6828918 | 0.80 | — | — | |
| Zinc Ion SCHEMBL7716916 | 0.80 | MAPK1 (0.50) | — | |
| Hydrochloric Acid SCHEMBL18760007 | 0.80 | — | — | |
| Water SCHEMBL2356195 | 0.80 | — | — | |
| SCHEMBL17025954 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL8667976 | 0.73 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5624472-A | Method for dry grinding with improved magnesium oxychloride cement bond containing graphite | WESTERN ATLAS, INC. (US) | 1997-04-29 | — | — | US | disclosed |
| US-5460635-A | Improved heat strength, cooler grinding temperature | WESTERN ATLAS INC. (US) | 1995-10-24 | — | — | US | disclosed |
| US-4436555-A | Magnesium phosphate glass cements with ceramic-type properties | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) | 1984-03-13 | — | — | US | disclosed |