⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1460344 | 0.85 | — | — | |
| SCHEMBL1460343 | 0.79 | — | — | |
| Hypophosphorous Acid SCHEMBL3477491 | 0.78 | — | — | |
| SCHEMBL7659351 | 0.77 | — | — | |
| SCHEMBL11596675 | 0.75 | LPAR3 (0.47) | — | |
| SCHEMBL9229901 | 0.75 | — | — | |
| SCHEMBL10932896 | 0.75 | — | — | |
| Tromethamine SCHEMBL7552450 | 0.71 | MEN1 (0.34) | — | |
| SCHEMBL10539182 | 0.70 | — | — | |
| SCHEMBL11666730 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0735039-B1 | A process for preparing tribromoneopentyl chloroalkyl phosphates | DAIHACHI CHEM IND (JP) | 2002-06-19 | — | — | EP | disclosed |
| EP-0808840-B1 | Process for preparing tribromoneopentyl chloroalkyl phosphates | DAIHACHI CHEM IND (JP) | 2002-02-06 | — | — | EP | disclosed |
| EP-1129158-A1 | MIXED ESTERS OF PENTAERYTHRITOL FOR REFRIGERATION BASE OILS | Nippon Mitsubishi Oil Corporation (JP) | 2001-09-05 | — | — | EP | disclosed |
| US-6231782-B1 | HYDROCARBON OIL, ALICYCLIC POLYCARBOXYLIC ACID ESTER COMPOUND HAVING AN ALICYCLIC RING AND AT LEAST TWO ESTER GROUPS, REFRIGERANT SELECTED FROM HYDROFLUOROCARBON REFRIGERANTS, FLUORINE-CONTAINING, FLUORINE-FREE ETHERS | NIPPON MITSUBISHI OIL CORP. (JP) | 2001-05-15 | — | — | US | disclosed |
| WO-2000014189-A1 | MIXED ESTERS OF PENTAERYTHRITOL FOR REFRIGERATION BASE OILS | NIPPON MITSUBISHI OIL CORPORATION (JP) | 2000-03-16 | — | — | WO | disclosed |
| US-5756797-A | REACTING ALKYLENE OXIDE WITH PHOSPHORUS TRICHLORIDE; THEN CHLORINE AND TRIBROMONEOPENTYL ALCOHOL | DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) | 1998-05-26 | — | — | US | disclosed |
| EP-0808840-A1 | Process for preparing tribromoneopentyl chloroalkyl phosphates | DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) | 1997-11-26 | — | — | EP | disclosed |
| US-5627299-A | REACTION OF ALCOHOL WITH PHOSPHOROUS OXYCHLORIDE TO FORM PHOSPHATES | DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) | 1997-05-06 | — | — | US | disclosed |
| EP-0735039-A2 | A process for preparing tribromoneopentyl chloroalkyl phosphates | DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) | 1996-10-02 | — | — | EP | disclosed |