⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL19637945 | 0.96 | — | — | |
| SCHEMBL3199936 | 0.79 | — | — | |
| Bromide SCHEMBL5883846 | 0.76 | — | — | |
| Bromide SCHEMBL19637938 | 0.74 | — | — | |
| SCHEMBL11605184 | 0.72 | — | — | |
| SCHEMBL5279725 | 0.70 | — | — | |
| Bromide SCHEMBL19638423 | 0.69 | — | — | |
| SCHEMBL4635 | 0.67 | — | — | |
| Iodide SCHEMBL22027516 | 0.67 | — | — | |
| SCHEMBL22027595 | 0.67 | TSHR (0.44) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3670484-B1 | PROCESSES FOR PREPARING 4-METHYL-5-NONANONE AND 4-METHYL-5-NONANOL | SHINETSU CHEMICAL CO (JP) | 2022-03-02 | — | — | EP | disclosed |
| CN-111348994-A | Process for preparing 4-methyl-5-nonanone and 4-methyl-5-nonanol | 信越化学工业株式会社 | 2020-06-30 | — | — | CN | disclosed |
| EP-3670484-A1 | PROCESSES FOR PREPARING 4-METHYL-5-NONANONE AND 4-METHYL-5-NONANOL | Shin-Etsu Chemical Co., Ltd. (JP) | 2020-06-24 | — | — | EP | disclosed |
| EP-0530814-B1 | Method for producing a stereospecific polyolefin | TOSOH CORP (JP) | 1998-12-16 | — | — | EP | disclosed |
| US-5489634-A | EFFICIENT SELECTIVE CATALYTIC POLYMERIZATION OF ALPHA-OLEFINS YIELDS HIGH MOLECULAR WEIGHT SPHERICAL PARTICLES HAVING HIGH BULK DENSITY, CONTROLLED PARTICLE SIZE AND MOLECULAR WEIGHT DISTRIBUTION | TOSOH CORPORATION (JP) | 1996-02-06 | — | — | US | disclosed |
| EP-0530814-A1 | Method for producing a stereospecific polyolefin | TOSOH CORPORATION (JP) | 1993-03-10 | — | — | EP | disclosed |