⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15132741 | 0.89 | — | — | |
| SCHEMBL2455130 | 0.85 | KDM4E (0.31) | — | |
| SCHEMBL6023550 | 0.80 | KDM4E (0.35) | — | |
| SCHEMBL30084769 | 0.76 | KDM4E (0.33) | — | |
| Hydrochloric Acid SCHEMBL28564370 | 0.76 | KDM4E (0.33) | — | |
| SCHEMBL31255671 | 0.76 | KDM4E (0.33) | — | |
| Hydrochloric Acid SCHEMBL28783865 | 0.76 | KDM4E (0.33) | — | |
| SCHEMBL13416648 | 0.74 | — | — | |
| SCHEMBL10093880 | 0.74 | — | — | |
| SCHEMBL13416745 | 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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3515957-A1 | BIORENEWABLE HIGH PERFORMANCE POLYESTER POLYOLS | PTT Global Chemical Public Company Limited (TH) | 2019-07-31 | — | — | EP | disclosed |
| WO-2018058016-A1 | BIORENEWABLE HIGH PERFORMANCE POLYESTER POLYOLS | MYRIANT CORPORATION (US) | 2018-03-29 | — | — | WO | disclosed |
| EP-3004196-A1 | CO2 CONTAINING FOAMS AND RELATED METHODS | Novomer, Inc. (US) | 2016-04-13 | — | — | EP | disclosed |
| US-9243199-B2 | Fuel compositions | INNOSPEC LIMITED (GB) | 2016-01-26 | — | — | US | disclosed |
| WO-2014186397-A1 | CO2 CONTAINING FOAMS AND RELATED METHODS | NOVOMER, INC. (US) | 2014-11-20 | — | — | WO | disclosed |
| EP-2688953-A1 | PHOSPHOROUS-CONTAINING FLAME RETARDANTS FOR POLYURETHANE FOAMS | Dow Global Technologies LLC (US) | 2014-01-29 | — | — | EP | disclosed |
| EP-2688898-A1 | PHOSPHOROUS-CONTAINING FLAME RETARDANTS FOR POLYURETHANE FOAMS | Dow Global Technologies LLC (US) | 2014-01-29 | — | — | EP | disclosed |
| EP-2621986-A1 | FLEXIBLE POLYURETHANE FOAMS | Dow Global Technologies LLC (US) | 2013-08-07 | — | — | EP | disclosed |
| US-20130186360-A1 | FUEL COMPOSITIONS | INNOSPEC LIMITED (GB) | 2013-07-25 | — | — | US | disclosed |
| WO-2012126380-A1 | PHOSPHOROUS-CONTAINING FLAME RETARDANTS FOR POLYURETHANE FOAMS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2012-09-27 | — | — | WO | disclosed |
| WO-2012126179-A1 | PHOSPHOROUS-CONTAINING FLAME RETARDANTS FOR POLYURETHANE FOAMS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2012-09-27 | — | — | WO | disclosed |
| WO-2012044616-A1 | FLEXIBLE POLYURETHANE FOAMS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2012-04-05 | — | — | WO | disclosed |
| EP-1753772-A1 | PHOSPHORUS-CONTAINING COMPOUNDS USEFUL FOR MAKING HALOGEN-FREE, IGNITION-RESISTANT POLYMERS | Dow Gloval Technologies Inc. (US) | 2007-02-21 | — | — | EP | disclosed |
| WO-2005118604-A1 | PHOSPHORUS-CONTAINING COMPOUNDS USEFUL FOR MAKING HALOGEN-FREE, IGNITION-RESISTANT POLYMERS | DOW GLOBAL TECHNOLOGIES INC. (US) | 2005-12-15 | — | — | WO | disclosed |
| EP-1326909-A2 | POLYURETHANES CONTAINING DISPERSED CRYSTALLINE POLYESTERS | DOW GLOBAL TECHNOLOGIES INC. (US) | 2003-07-16 | — | — | EP | disclosed |
| WO-2001088005-A2 | POLYURETHANES CONTAINING DISPERSED CRYSTALLINE POLYESTERS | DOW GLOBAL TECHNOLOGIES INC. (US) | 2001-11-22 | — | — | WO | disclosed |