⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4946930 | 0.81 | MEN1 (0.32) | — | |
| SCHEMBL5616374 | 0.78 | PBRM1 (0.31) | — | |
| SCHEMBL7811947 | 0.75 | GABRA1 (0.33) | — | |
| SCHEMBL7622106 | 0.75 | HSD11B1 (0.34) | — | |
| SCHEMBL7602465 | 0.75 | GABRA1 (0.33) | — | |
| SCHEMBL4083626 | 0.75 | LMNA (0.33) | — | |
| SCHEMBL3163967 | 0.74 | BRD4 (0.33) | — | |
| SCHEMBL5617474 | 0.74 | PIK3CD (0.35) | — | |
| SCHEMBL8369933 | 0.74 | IDO1 (0.30) | — | |
| SCHEMBL4237114 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1880986-B1 | PROCESS FOR PRODUCING SATURATED ALIPHATIC HYDROCARBONS, AND LUBRICANT COMPOSITIONS THEREOF | IDEMITSU KOSAN CO (JP) | 2013-03-06 | — | — | EP | disclosed |
| US-5449650-A | Catalyst components for polymerization of olefins and use thereof | MITSUBISHI PETROCHEMICAL COMPANY LIMITED (JP) | 1995-09-12 | — | — | US | disclosed |