⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5316577 | 0.80 | — | — | |
| SCHEMBL26615255 | 0.80 | GNAI3 (0.34) | — | |
| SCHEMBL18315351 | 0.79 | — | — | |
| SCHEMBL11787739 | 0.78 | — | — | |
| SCHEMBL18315353 | 0.77 | OPRM1 (0.50) | — | |
| SCHEMBL18315359 | 0.77 | OPRM1 (0.50) | — | |
| SCHEMBL11155476 | 0.77 | OPRM1 (0.50) | — | |
| SCHEMBL31532911 | 0.77 | OPRM1 (0.50) | — | |
| SCHEMBL8848619 | 0.77 | OPRM1 (0.50) | — | |
| SCHEMBL675007 | 0.76 | DNM1 (0.44) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0961770-B1 | PROCESSES FOR PRODUCING 3-CYANOPYRIDINE FROM 2-METHYL-1,5-PENTANEDIAMINE | REILLY IND INC (US) | 2003-09-24 | — | — | EP | disclosed |
| US-6118003-A | AMMOXIDATION | REILLY INDUSTRIES, INC. (US) | 2000-09-12 | — | — | US | disclosed |
| EP-0961770-A4 | PROCESSES FOR PRODUCING 3-CYANOPYRIDINE FROM 2-METHYL-1,5-PENTANEDIAMINE | REILLY IND INC (US) | 2000-04-19 | — | — | EP | disclosed |
| EP-0961770-A1 | PROCESSES FOR PRODUCING 3-CYANOPYRIDINE FROM 2-METHYL-1,5-PENTANEDIAMINE | REILLY INDUSTRIES, INC. (US) | 1999-12-08 | — | — | EP | disclosed |
| WO-1998032737-A1 | PROCESSES FOR PRODUCING 3-CYANOPYRIDINE FROM 2-METHYL-1,5-PENTANEDIAMINE | REILLY INDUSTRIES, INC. (US) | 1998-07-30 | — | — | WO | disclosed |