⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5892087 | 0.87 | NPC1 (0.34) | — | |
| SCHEMBL6742043 | 0.71 | — | — | |
| SCHEMBL28886735 | 0.69 | — | — | |
| SCHEMBL3435581 | 0.67 | TSHR (0.33) | — | |
| SCHEMBL11831122 | 0.66 | ALDH1A1 (0.53) | — | |
| Alanine SCHEMBL3261341 | 0.64 | — | — | |
| SCHEMBL322046 | 0.63 | — | — | |
| SCHEMBL10479105 | 0.62 | — | — | |
| SCHEMBL4411242 | 0.62 | MAPT (0.47) | — | |
| SCHEMBL11609568 | 0.62 | SMN1; SMN2 (0.41) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1262500-B1 | Catalyst for production of a polyurethane resin and method for producing a polyurethane resin | TOSOH CORP (JP) | 2015-12-30 | — | — | EP | disclosed |
| US-7064172-B2 | Catalyst for production of a polyurethane resin and method for producing a polyurethane resin | TOSOH CORPORATION (JP) | 2006-06-20 | — | — | US | disclosed |
| US-20040147705-A1 | Catalyst for production of a polyurethane resin and method for producting a polyurethane resin | TOSOH CORPORATION (JP) | 2004-07-29 | — | — | US | disclosed |
| US-6723819-B2 | TERTIARY NITROGEN CATALYSTS THAT MAY BE AMINES, IMIDAZOLES, AND/OR UREAS | TOSOH CORPORATION (JP) | 2004-04-20 | — | — | US | disclosed |
| US-20030088046-A1 | Catalyst for production of a polyurethane resin and method for producing a polyurethane resin | TOSOH CORPORATION (JP) | 2003-05-08 | — | — | US | disclosed |
| EP-1262500-A1 | Catalyst for production of a polyurethane resin and method for producing a polyurethane resin | Tosoh Corporation (JP) | 2002-12-04 | — | — | EP | disclosed |