⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL34475 | 0.82 | — | — | |
| SCHEMBL11691913 | 0.79 | — | — | |
| SCHEMBL10717201 | 0.79 | — | — | |
| SCHEMBL6684304 | 0.78 | SMPD1 (0.33) | — | |
| SCHEMBL11693750 | 0.78 | — | — | |
| Phosphoric Acid SCHEMBL1082091 | 0.77 | — | — | |
| SCHEMBL11694797 | 0.77 | — | — | |
| SCHEMBL10794992 | 0.77 | — | — | |
| SCHEMBL11692940 | 0.75 | — | — | |
| SCHEMBL11691722 | 0.74 | — | — |
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-4049754-A | Tribromoneopentyl phosphorus reactive flame retardants | STAUFFER CHEMICAL COMPANY (US) | 1977-09-20 | — | — | US | claimed |
| US-20100174007-A1 | Haloneopentyl Bis(ALKYL) Phosphate Ester, Flame Retardant Composition Containing Same and Polyurethane Foam Prepared Therewith | ICL-IP AMERICA INC. | 2010-07-08 | — | — | US | disclosed |
| EP-0735039-B1 | A process for preparing tribromoneopentyl chloroalkyl phosphates | DAIHACHI CHEM IND (JP) | 2002-06-19 | — | — | 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 |
| EP-0227528-B1 | PROCESS FOR PREPARING HALOGENATED TRIALKYL PHOSPHATE ESTERS | THE DOW CHEMICAL COMPANY (US) | 1990-03-14 | — | — | EP | disclosed |
| US-4714771-A | Process for preparing halogenated trialkyl phosphate esters | THE DOW CHEMICAL COMPANY (US) | 1987-12-22 | — | — | US | disclosed |
| US-4049754-A | Tribromoneopentyl phosphorus reactive flame retardants | STAUFFER CHEMICAL COMPANY (US) | 1977-09-20 | — | — | US | disclosed |
| US-3955028-A | BROMINATED PHOSPHITE ESTERS | STAUFFER CHEMICAL COMPANY (US) | 1976-05-04 | — | — | US | disclosed |