⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL195749 | 0.92 | — | — | |
| SCHEMBL6740341 | 0.87 | TSHR (0.36) | — | |
| SCHEMBL10521955 | 0.84 | ADH1B (0.39) | — | |
| SCHEMBL1922150 | 0.81 | — | — | |
| SCHEMBL28617279 | 0.81 | TSHR (0.36) | — | |
| SCHEMBL23199323 | 0.79 | ALOX15 (0.42) | — | |
| SCHEMBL9346781 | 0.79 | TSHR (0.40) | — | |
| SCHEMBL812730 | 0.79 | LMNA (0.46) | — | |
| SCHEMBL14231129 | 0.78 | MAPT (0.42) | — | |
| SCHEMBL277790 | 0.77 | — | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010063739-A1 | POLYURETHANE COMPOSITION COMPRISING HYDROXYALDIMINES | SIKA TECHNOLOGY AG (CH) | 2010-06-10 | — | — | WO | disclosed |
| EP-1021392-B1 | PROCESSES FOR PRODUCING HYDROXYALDEHYDES | UNION CARBIDE CHEM PLASTIC (US) | 2002-12-18 | — | — | EP | disclosed |
| EP-0900183-B1 | PROCESSES FOR PRODUCING 1,6-HEXANEDIOLS | UNION CARBIDE CHEM PLASTIC (US) | 2002-11-13 | — | — | EP | disclosed |
| EP-0900187-B1 | PROCESSES FOR PRODUCING HYDROXYALDEHYDES | UNION CARBIDE CHEM PLASTIC (US) | 2002-09-04 | — | — | EP | disclosed |
| US-6300496-B1 | REDUCTIVE AMINATION, OXAMIDATION, OXIDATION, DEHYDRATION, AMIDATION, CYCLIZATION OF VARIOUS PRECURSORS | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION | 2001-10-09 | — | — | US | disclosed |
| WO-2001025195-A1 | PROCESSES FOR PRODUCING EPSILON CAPROLACTAMS | UNION CARBIDE CHEMICALS & PLASTICS (US) | 2001-04-12 | — | — | WO | disclosed |
| US-6187970-B1 | REDUCTIVE HYDROFORMYLATION AND ISOMERIZATION CATALYSTS | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION | 2001-02-13 | — | — | US | disclosed |
| EP-1021392-A1 | PROCESSES FOR PRODUCING HYDROXYALDEHYDES | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 2000-07-26 | — | — | EP | disclosed |
| CN-1222901-A | Processes for producing 1,6-hexanediols | UNION CARBIDE CHEM PLASTIC (US) | 1999-07-14 | — | — | CN | disclosed |
| CN-1222903-A | Process for producing aldol | UNION CARBIDE CHEM PLASTIC (US) | 1999-07-14 | — | — | CN | disclosed |
| CN-1222904-A | Processes for producing hydroxyaldehydes | UNION CARBIDE CHEM PLASTIC (US) | 1999-07-14 | — | — | CN | disclosed |
| EP-0900183-A1 | PROCESSES FOR PRODUCING 1,6-HEXANEDIOLS | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1999-03-10 | — | — | EP | disclosed |
| EP-0900187-A1 | PROCESSES FOR PRODUCING HYDROXYALDEHYDES | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1999-03-10 | — | — | EP | disclosed |
| US-5821389-A | SUBJECTING ALKADIENE TO REDUCTIVE HYDROFORMYLATION IN PRESENCE OF CATALYST AND HYDROFORMYLATION IN PRESENCE OF CATALYST | UNION CARBIDE CHEMICALS & TECHNOLOGY CORPORATION (US) | 1998-10-13 | — | — | US | disclosed |
| US-5817883-A | HYDROCARBONYLATION AND HYDROFORMYLATION OF ALKADIENES OR HYDROCARBONYLATION OF PENTANALS | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1998-10-06 | — | — | US | disclosed |
| WO-1997039997-A1 | PROCESSES FOR PRODUCING 1,6-HEXANEDIOLS | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1997-10-30 | — | — | WO | disclosed |
| WO-1997040000-A1 | PROCESSES FOR PRODUCING HYDROXYALDEHYDES | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1997-10-30 | — | — | WO | disclosed |
| WO-1997040001-A1 | PROCESSES FOR PRODUCING HYDROXYALDEHYDES | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1997-10-30 | — | — | WO | disclosed |