⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14283394 | 0.70 | — | — | |
| SCHEMBL838061 | 0.70 | — | — | |
| SCHEMBL8800727 | 0.67 | — | — | |
| SCHEMBL7039373 | 0.65 | — | — | |
| SCHEMBL133666 | 0.64 | — | — | |
| SCHEMBL4906133 | 0.61 | KMT2A (0.36) | — | |
| SCHEMBL7617771 | 0.60 | MAPT (0.42) | — | |
| SCHEMBL3477590 | 0.56 | CYP1A2 (0.48) | — | |
| SCHEMBL588013 | 0.56 | — | — | |
| SCHEMBL4901963 | 0.55 | — | — |
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-0974586-A1 | 2-amino-4-alkylamino-pyrimidine 3-oxydes and compositions containing same | L'OREAL (FR) | 2000-01-26 | — | — | EP | disclosed |
| WO-1989007595-A1 | SPIROAZA DERIVATIVES OF HETEROCYCLIC N-OXIDES AND THEIR USE IN HAIR GROWTH PROMOTION | BAZZANO GAIL S (US) | 1989-08-24 | — | — | WO | disclosed |
| US-4232154-A | Carbocyclic analogs of cytosine nucleosides exhibiting antiviral and antineoplasticactivity | UNITED STATES OF AMERICA (US) | 1980-11-04 | — | — | US | disclosed |
| US-4177348-A | VIRICIDES, ANTINEOPLASTIC, ANTILEUKEMIA, ANTICANCER | UNITED STATES GOVERNMENT (US) | 1979-12-04 | — | — | US | disclosed |
| US-3998827-A | HYPOTENSIVE AGENTS | THE UPJOHN COMPANY (US) | 1976-12-21 | — | — | US | disclosed |