⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2906407 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL11225335 | 0.63 | — | — | |
| Bromide SCHEMBL19031060 | 0.63 | — | — | |
| SCHEMBL11498234 | 0.60 | — | — | |
| SCHEMBL23546 | 0.59 | — | — | |
| SCHEMBL23732 | 0.59 | — | — | |
| SCHEMBL1328 | 0.59 | — | — | |
| SCHEMBL8852489 | 0.59 | TSHR (0.54) | — | |
| SCHEMBL23116592 | 0.56 | — | — | |
| SCHEMBL20507075 | 0.56 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118852080-A | Chiral amino chromanone derivative and synthesis method thereof | 上海市奉贤区中心医院 | 2024-10-29 | — | — | CN | disclosed |
| CN-115448949-B | Synthesis method of chiral allylphosphine compound | 陕西师范大学 | 2024-03-22 | — | — | CN | disclosed |
| CN-113912577-B | Rockwell intermediate, rockwell and its derivative, and preparation and application | 深圳湾实验室 | 2023-12-29 | — | — | CN | disclosed |
| CN-114133367-B | Preparation method of sulfoxide imido dihydropyrone derivative | 大连理工常熟研究院有限公司 | 2023-03-21 | — | — | CN | disclosed |
| CN-115448949-A | Synthesis method of chiral allyl phosphine compound | 陕西师范大学 | 2022-12-09 | — | — | CN | disclosed |
| CN-114133367-A | Preparation method of sulphoxide imino dihydropyrone derivatives | 大连理工常熟研究院有限公司 | 2022-03-04 | — | — | CN | disclosed |
| US-8524963-B2 | Solid hydrogenation catalyst | LOS ALAMOS NATIONAL SECURITY, LLC (US) | 2013-09-03 | — | — | US | disclosed |
| US-20080249343-A1 | Supported organoiridium catalysts for alkane dehydrogenation | TRIAD NATIONAL SECURITY, LLC | 2008-10-09 | — | — | US | disclosed |