⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31474645 | 0.87 | — | — | |
| SCHEMBL11215818 | 0.87 | — | — | |
| SCHEMBL31474666 | 0.75 | — | — | |
| SCHEMBL6450303 | 0.75 | — | — | |
| SCHEMBL31175650 | 0.71 | — | — | |
| SCHEMBL1255616 | 0.71 | — | — | |
| SCHEMBL29612145 | 0.71 | — | — | |
| SCHEMBL1255618 | 0.71 | — | — | |
| SCHEMBL8447756 | 0.71 | — | — | |
| SCHEMBL29353675 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6045689-A | PRESTEAMED MULTI-FUNCTIONAL CATALYST WITH AN ALUMINA MATRIX MODIFIED BY SILICA, A HALOGEN, A NOBLE METAL AND A PROMOTER METAL; REFORMING OF GASOLINES; TRANSFORMING N-PARAFFINS AND NAPHTHENES INTO AROMATICS AND LIGHT PARAFFINS; DURABILITY | INSTITUT FRANCAIS DU PETROLE (FR) | 2000-04-04 | — | — | US | disclosed |