⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1855821 | 0.82 | — | — | |
| SCHEMBL11599227 | 0.80 | — | — | |
| SCHEMBL6259861 | 0.76 | KMT2A (0.45) | — | |
| Acetic Acid SCHEMBL10833165 | 0.72 | — | — | |
| SCHEMBL9289418 | 0.71 | — | — | |
| SCHEMBL6438119 | 0.71 | NPSR1 (0.32) | — | |
| SCHEMBL252695 | 0.70 | — | — | |
| SCHEMBL4439610 | 0.70 | — | — | |
| SCHEMBL1855272 | 0.68 | MMP12 (0.38) | — | |
| SCHEMBL7695919 | 0.67 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0015557-B1 | AQUEOUS DISPERSIONS OF PRIMARY AROMATIC AMINES AND THEIR USE IN PRODUCING WATER-INSOLUBLE AZODYESTUFFS ON THE FIBRE AND THE USE OF AN ANIONIC TENSIDE TO PRODUCE THESE DISPERSIONS | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-01-19 | — | — | EP | disclosed |