⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9308476 | 0.89 | — | — | |
| SCHEMBL6013858 | 0.89 | — | — | |
| SCHEMBL30774 | 0.89 | — | — | |
| Bromide SCHEMBL28548994 | 0.86 | GABRR1 (0.38) | — | |
| Water SCHEMBL4908320 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL17242651 | 0.86 | — | — | |
| Sulfurous Acid SCHEMBL11034327 | 0.81 | GABRR1 (0.38) | — | |
| Acetic Acid SCHEMBL9812224 | 0.79 | GABRR1 (0.48) | — | |
| Perchlorate SCHEMBL11635227 | 0.75 | GABRR1 (0.32) | — | |
| Carbonotrithioic Acid SCHEMBL28273373 | 0.75 | CA1 (0.35) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2158242-B1 | WATER-STABLE CATALYSTS FOR POLYURETHANE MANUFACTURE | DORF KETAL CHEMICALS INDIA PRIVATE LTD (IN) | 2019-12-25 | — | — | EP | disclosed |
| CN-105218772-A | For the water stability catalyzer of polyurethane production | DORF KETAL CHEMICALS INDIA PVT LTD | 2016-01-06 | — | — | CN | disclosed |
| CN-101679582-B | Water stable catalysts for polyurethane production | DORF KETAL CHEMICALS INDIA Pvt.,Ltd. (IN) | 2015-09-23 | — | — | CN | disclosed |
| US-8829145-B2 | Water-stable catalysts for polyurethane manufacture | DORF KETAL CHEMICALS (INDIA) PVT. LTD. (IN) | 2014-09-09 | — | — | US | disclosed |
| US-20100311937-A1 | METHOD AND CATALYST FOR THE MANUFACTURE OF A POLYURETHANE | JOHNSON MATTHEY PLC (GB) | 2010-12-09 | — | — | US | disclosed |
| US-20100249359-A1 | WATER-STABLE CATALYSTS FOR POLYURETHANE MANUFACTURE | JOHNSON MATTHEY PLC (GB) | 2010-09-30 | — | — | US | disclosed |
| EP-2215137-A2 | METHOD AND CATALYST FOR THE MANUFACTURE OF A POLYURETHANE | JOHNSON MATTHEY PLC (GB) | 2010-08-11 | — | — | EP | disclosed |
| CN-101679582-A | Water stable catalysts for polyurethane production | JOHNSON MATTHEY PLC | 2010-03-24 | — | — | CN | disclosed |
| EP-2158242-A1 | WATER-STABLE CATALYSTS FOR POLYURETHANE MANUFACTURE | Johnson Matthey PLC (GB) | 2010-03-03 | — | — | EP | disclosed |
| WO-2009063245-A2 | METHOD AND CATALYST FOR THE MANUFACTURE OF A POLYURETHANE | JOHNSON MATTHEY PLC (GB) | 2009-05-22 | — | — | WO | disclosed |
| WO-2008155569-A1 | WATER-STABLE CATALYSTS FOR POLYURETHANE MANUFACTURE | JOHNSON MATTHEY PLC (GB) | 2008-12-24 | — | — | WO | disclosed |