⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5001830 | 1.00 | — | — | |
| SCHEMBL8925744 | 0.87 | HCAR2 (0.48) | — | |
| SCHEMBL10394952 | 0.87 | HCAR2 (0.48) | — | |
| SCHEMBL17718034 | 0.87 | GSTP1 (0.42) | — | |
| SCHEMBL27872881 | 0.81 | ALDH1A1 (0.41) | — | |
| SCHEMBL4575905 | 0.80 | — | — | |
| SCHEMBL11572843 | 0.79 | ATM (0.45) | — | |
| SCHEMBL17305549 | 0.79 | HCAR2 (0.40) | — | |
| SCHEMBL10394953 | 0.79 | HCAR2 (0.61) | — | |
| SCHEMBL10394955 | 0.79 | HCAR2 (0.61) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11771688-B2 | Pyridine derivatives substituted by heterocyclic ring and amino group | AMPLYX PHARMACEUTICALS, INC. (US) | 2023-10-03 | — | — | US | disclosed |
| EP-1998222-B1 | Coating compositions | ROHM & HAAS ELECT MAT (US) | 2013-03-20 | — | — | EP | disclosed |
| EP-1998222-A2 | Coating compositions | Rohm and Haas Electronic Materials LLC (US) | 2008-12-03 | — | — | EP | disclosed |
| US-20080248331-A1 | Coating composition | ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) | 2008-10-09 | — | — | US | disclosed |