⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1123106 | 0.83 | OPRM1 (0.41) | — | |
| SCHEMBL6706822 | 0.81 | OPRM1 (0.39) | — | |
| SCHEMBL6708445 | 0.81 | OPRM1 (0.39) | — | |
| SCHEMBL557560 | 0.81 | OPRM1 (0.39) | — | |
| SCHEMBL6708434 | 0.81 | OPRM1 (0.39) | — | |
| SCHEMBL23282510 | 0.80 | GABRR1 (0.30) | — | |
| SCHEMBL2909526 | 0.79 | — | — | |
| SCHEMBL23282521 | 0.78 | — | — | |
| SCHEMBL6143152 | 0.78 | — | — | |
| SCHEMBL6711951 | 0.76 | CHRM1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9181356-B2 | Hydrogenation catalyst composition and hydrogenation method thereof | TSRC CORPORATION (TW) | 2015-11-10 | — | — | US | disclosed |
| EP-2316862-B1 | Hydrogenation catalyst composition and hydrogenation method thereof | TSRC CORP (TW) | 2013-12-25 | — | — | EP | disclosed |
| CN-101829600-B | Hydrogenation catalyst composition and hydrogenation method thereof | TSRC CORP | 2012-08-29 | — | — | CN | disclosed |
| US-20110105694-A1 | HYDROGENATION CATALYST COMPOSITION AND HYDROGENATION METHOD THEREOF | TSRC CORPORATION (TW) | 2011-05-05 | — | — | US | disclosed |
| EP-2316862-A1 | Hydrogenation catalyst composition and hydrogenation method thereof | TSRC Corporation (TW) | 2011-05-04 | — | — | EP | disclosed |
| CN-101829600-A | Hydrogenation catalyst composition and hydrogenation method thereof | TSRC CORP | 2010-09-15 | — | — | CN | disclosed |
| US-20040028978-A1 | Proton conducting membrane, method for producing the same, and fuel cell using the same | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2004-02-12 | — | — | US | disclosed |
| EP-1334993-A2 | Proton conducting membrane, method for producing the same, and fuel cell using the same | National Institute of Advanced Industrial Science and Technology (JP) | 2003-08-13 | — | — | EP | disclosed |