⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7935974 | 0.81 | — | — | |
| SCHEMBL23851630 | 0.80 | KDM4E (0.36) | — | |
| SCHEMBL7932076 | 0.75 | PDE4A (0.33) | — | |
| SCHEMBL15816170 | 0.74 | KDM4E (0.33) | — | |
| SCHEMBL24310408 | 0.71 | KDM4E (0.32) | — | |
| SCHEMBL29515147 | 0.71 | KDM4E (0.32) | — | |
| SCHEMBL7932057 | 0.67 | KMT2A (0.36) | — | |
| SCHEMBL24310127 | 0.67 | ADORA2A (0.35) | — | |
| SCHEMBL24310175 | 0.67 | ADORA2A (0.32) | — | |
| SCHEMBL7808650 | 0.64 | KMT2A (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6235904-B1 | VALUABLE INTERMEDIATES FOR ORGANIC SYNTHESES, ESPECIALLY FOR PREPARING CROP PROTECTION AGENTS. | BASF AKTIENGESELLSCHAFT (DE) | 2001-05-22 | — | — | US | disclosed |
| US-5283332-A | 2-amino(fluoroalkoxy)pyrimidines and the preparation thereof | BASF AKTIENGESELLSCHAFT (DE) | 1994-02-01 | — | — | US | disclosed |
| EP-0445642-A1 | 2-Amino-(fluoralkoxy-pyrimidines) and process for their preparation | BASF Aktiengesellschaft (DE) | 1991-09-11 | — | — | EP | disclosed |