⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5762547 | 1.00 | — | — | |
| SCHEMBL5761970 | 1.00 | — | — | |
| SCHEMBL22660732 | 0.83 | KMT2A (0.44) | — | |
| SCHEMBL22660731 | 0.83 | KMT2A (0.44) | — | |
| SCHEMBL1933837 | 0.83 | KMT2A (0.44) | — | |
| SCHEMBL11319232 | 0.81 | KMT2A (0.42) | — | |
| SCHEMBL11306317 | 0.79 | KMT2A (0.41) | — | |
| SCHEMBL5029010 | 0.79 | — | — | |
| SCHEMBL10034950 | 0.79 | — | — | |
| SCHEMBL5369524 | 0.79 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1611113-A1 | PROCESS TO PRODUCE ENANTIOMERICALLY ENRICHED 1-ARYL- AND 1-HETEROARYL-2-AMINOETHANOLS | Pharmacia & Upjohn Company LLC (US) | 2006-01-04 | — | — | EP | disclosed |
| US-20040236151-A1 | Process to produce enantiomerically enriched 1-aryl-and 1-heteroaryl-2-aminoethanols | PFIZER, INC. | 2004-11-25 | — | — | US | disclosed |
| WO-2004085414-A1 | PROCESS TO PRODUCE ENANTIOMERICALLY ENRICHED 1-ARYL- AND 1-HETEROARYL-2-AMINOETHANOLS | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-10-07 | — | — | WO | disclosed |