⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL366631 | 0.75 | ALDH1A1 (0.45) | — | |
| Ammonia Solution, Strong SCHEMBL9795266 | 0.73 | ALDH1A1 (0.43) | — | |
| SCHEMBL209325 | 0.72 | ALDH1A1 (0.38) | — | |
| SCHEMBL15543102 | 0.71 | — | — | |
| SCHEMBL19433090 | 0.71 | — | — | |
| SCHEMBL2906570 | 0.71 | — | — | |
| SCHEMBL369385 | 0.71 | — | — | |
| SCHEMBL1157706 | 0.71 | — | — | |
| SCHEMBL11415531 | 0.71 | — | — | |
| SCHEMBL175717 | 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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107974089-B | Preparation of isotropic super-hydrophobic super-oleophobic regular porous silicone rubber through anisotropic structure | 中物院成都科学技术发展中心 | 2020-08-25 | — | — | CN | claimed |
| CN-107974089-A | The super-hydrophobic superoleophobic regular porous silicone rubber of isotropism is prepared by anisotropic structure | 中物院成都科学技术发展中心 | 2018-05-01 | — | — | CN | claimed |
| JP-4216713-B2 | — | — | 2009-01-28 | — | — | JP | claimed |
| EP-1404324-A4 | PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF | XENOPORT INC (US) | 2004-12-22 | — | — | EP | claimed |
| JP-2004536873-A | — | — | 2004-12-09 | — | — | JP | claimed |
| EP-1404324-A2 | PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF | Xenoport, Inc. (US) | 2004-04-07 | — | — | EP | claimed |
| US-20030176398-A1 | Prodrugs of GABA analogs, compositions and uses thereof | HPS INVESTMENT PARTNERS, LLC, AS ADMINISTRATIVE AGENT | 2003-09-18 | — | — | US | claimed |
| WO-2002100347-A2 | PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF | XENOPORT, INC. (US) | 2002-12-19 | — | — | WO | claimed |
| CN-108034258-B | High-barrier silicone rubber graphene composite material and preparation method thereof | 中物院成都科学技术发展中心 | 2022-11-15 | — | — | CN | disclosed |
| CN-107974089-B | Preparation of isotropic super-hydrophobic super-oleophobic regular porous silicone rubber through anisotropic structure | 中物院成都科学技术发展中心 | 2020-08-25 | — | — | CN | disclosed |
| CN-108034258-A | A kind of high-barrier silicon rubber graphene composite material and preparation method thereof | 中物院成都科学技术发展中心 | 2018-05-15 | — | — | CN | disclosed |
| CN-107974089-A | The super-hydrophobic superoleophobic regular porous silicone rubber of isotropism is prepared by anisotropic structure | 中物院成都科学技术发展中心 | 2018-05-01 | — | — | CN | disclosed |
| EP-2085087-A1 | Prodrugs of gaba analogs, compositions and uses thereof | Xenoport, Inc. (US) | 2009-08-05 | — | — | EP | disclosed |
| EP-1902714-A1 | Prodrugs of gaba analogs, compositions and uses thereof | Xenoport, Inc. (US) | 2008-03-26 | — | — | EP | disclosed |