⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1835939 | 0.97 | — | — | |
| SCHEMBL9096323 | 0.94 | — | — | |
| Butane SCHEMBL5724438 | 0.87 | — | — | |
| Trimethylammonium SCHEMBL28300204 | 0.87 | — | — | |
| SCHEMBL3360177 | 0.81 | — | — | |
| SCHEMBL3362763 | 0.79 | — | — | |
| SCHEMBL220514 | 0.78 | — | — | |
| SCHEMBL16334550 | 0.77 | — | — | |
| SCHEMBL9277190 | 0.77 | — | — | |
| SCHEMBL19183273 | 0.77 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4436899-A | REACTION OF ORGANIC PHOSPHONATE OR PHOSPHATE WITH TETRAVALENT METAL COMPOUND | OCCIDENTAL RESEARCH CORPORATION (US) | 1984-03-13 | — | — | US | disclosed |
| EP-0010857-B1 | LAYERED OR AMORPHOUS ORGANOMETALLIC INORGANIC POLYMERS AND THEIR USE | OCCIDENTAL RESEARCH CORPORATION (US) | 1982-10-20 | — | — | EP | disclosed |
| US-4299943-A | PRODUCED BY REACTING SILYL DIESTER OF A PENTAVALENT ORGANIC METAL ACID WITH A TETRAVALENT METAL | OCCIDENTAL RESEARCH CORPORATION (US) | 1981-11-10 | — | — | US | disclosed |
| US-4298723-A | ION EXCHANGERS, CATALYSTS, SORBENTS, CONTROLLED RELEASE, INTERCALATION COMPOUNDS | OCCIDENTAL RESEARCH CORPORATION (US) | 1981-11-03 | — | — | US | disclosed |
| US-4256872-A | INTERCALATION COMPOUNDS PREPARED BY THE METATHESIS REACTION IN LIQUID PHASE OF AN INORGANIC TETRAVALENT METAL COMPOUND AND AN ORGANIC PHOSPHONATE; ION EXCHANGERS | OCCIDENTAL RESEARCH CORPORATION (US) | 1981-03-17 | — | — | US | disclosed |
| US-4235990-A | CRYSTALS WHICH DISPLAY INTERCALATION ACTIVITY OR CAN BE AMORPHOUS | OCCIDENTAL RESEARCH CORPORATION (US) | 1980-11-25 | — | — | US | disclosed |
| US-4232146-A | Process for preparing layered organophosphorus inorganic polymers | OCCIDENTAL RESEARCH CORPORATION (US) | 1980-11-04 | — | — | US | disclosed |
| EP-0010857-A2 | Layered or amorphous organometallic inorganic polymers and their use | OCCIDENTAL RESEARCH CORPORATION (US) | 1980-05-14 | — | — | EP | disclosed |
| WO-1980000704-A1 | LAYERED OR AMORPHOUS ORGANOMETALLIC INORGANIC POLYMERS | OCCIDENTAL RES CORP (US) | 1980-04-17 | — | — | WO | disclosed |