⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3946348 | 0.98 | GAA (0.50) | — | |
| SCHEMBL6212305 | 0.93 | ALDH1A1 (0.55) | — | |
| SCHEMBL20444187 | 0.91 | ALDH1A1 (0.52) | — | |
| SCHEMBL15046188 | 0.91 | ALDH1A1 (0.52) | — | |
| SCHEMBL28874561 | 0.91 | ALDH1A1 (0.52) | — | |
| SCHEMBL28975319 | 0.91 | ALDH1A1 (0.52) | — | |
| SCHEMBL8190532 | 0.91 | ALDH1A1 (0.52) | — | |
| SCHEMBL9414616 | 0.87 | PAOX (0.41) | — | |
| SCHEMBL9557758 | 0.84 | — | — | |
| SCHEMBL21991374 | 0.83 | GAA (0.51) | — |
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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0912467-B1 | ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE | RHODIA CHIMIE SA (FR) | 2002-04-24 | — | — | EP | claimed |
| EP-0912467-A1 | ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE | RHODIA CHIMIE (FR) | 1999-05-06 | — | — | EP | claimed |
| WO-1998000375-A1 | ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE | RHODIA CHIMIE (FR) | 1998-01-08 | — | — | WO | claimed |
| CN-110028760-B | Piezoresistive material | 纳米及先进材料研发院有限公司 | 2021-07-27 | — | — | CN | disclosed |
| US-10745512-B2 | Piezo-resistive materials | NANO AND ADVANCED MATERIALS INSTITUTE LIMITED (CN) | 2020-08-18 | — | — | US | disclosed |
| CN-110028760-A | Pressure drag material | 纳米及先进材料研发院有限公司 | 2019-07-19 | — | — | CN | disclosed |
| US-20190218333-A1 | Piezo-resistive Materials | NANO AND ADVANCED MATERIALS INSTITUTE LIMITED (CN) | 2019-07-18 | — | — | US | disclosed |
| CN-108864399-A | A kind of organic-silicon-modified flame retardant polyurethane and its preparation | 汕头大学 | 2018-11-23 | — | — | CN | disclosed |
| CN-105566100-B | A kind of styrene acid compounds, including its composition and its application | 东莞安好医药科技有限公司 | 2018-11-02 | — | — | CN | disclosed |
| CN-105153387-B | A kind of polyurethane amino resins modified water-based alkyd resin and preparation and application | 华南理工大学 | 2018-01-05 | — | — | CN | disclosed |
| US-9845399-B2 | Sublimation ink for transfer printing | NANO AND ADVANCED MATERIALS INSTITUTE LIMITED (HK) | 2017-12-19 | — | — | US | disclosed |
| EP-1153031-A1 | METHOD FOR PREPARING CHIRAL DIPHOSPHINES | RHODIA CHIMIE (FR) | 2001-11-14 | — | — | EP | disclosed |
| WO-2001074828-A1 | WATER SOLUBLE CHIRAL DIPHOSPHINES | RHODIA CHIMIE (FR) | 2001-10-11 | — | — | WO | disclosed |
| US-6166257-A | METAL COMPLEX OF AN OPTICALLY ACTIVE BIS(1-PHOSPHA-2,3-DIPHENYL-4,5-DIMETHYLNORBORNADIENE) | RHODIA CHIMIE (FR) | 2000-12-26 | — | — | US | disclosed |
| WO-2000052081-A1 | OPTICALLY ACTIVE LINEAR POLYMER USED AS LIGAND IN THE PREPARATION OF METALLIC COMPLEXES DESIGNED FOR ASYMMETRIC CATALYSIS | RHODIA CHIMIE (FR) | 2000-09-08 | — | — | WO | disclosed |
| WO-2000049028-A1 | METHOD FOR PREPARING CHIRAL DIPHOSPHINES | RHODIA CHIMIE (FR) | 2000-08-24 | — | — | WO | disclosed |
| EP-0912467-A1 | ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE | RHODIA CHIMIE (FR) | 1999-05-06 | — | — | EP | disclosed |
| WO-1998000375-A1 | ASYMMETRIC HYDROGENATION METHOD OF A KETONIC COMPOUND AND DERIVATIVE | RHODIA CHIMIE (FR) | 1998-01-08 | — | — | WO | disclosed |
| EP-0295890-B1 | PROCESS OF PREPARING OPTICALLY ACTIVE ALCOHOL | Takasago International Corporation (JP) | 1992-09-16 | — | — | EP | disclosed |
| US-5066815-A | Asymmetric hydrogenation of ketone, ruthenium-phosphine catalyst | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1991-11-19 | — | — | US | disclosed |