⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22117211 | 0.82 | ALDH1A1 (0.32) | — | |
| SCHEMBL1381917 | 0.78 | — | — | |
| SCHEMBL88328 | 0.78 | — | — | |
| SCHEMBL31102 | 0.76 | — | — | |
| SCHEMBL1414776 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL7803378 | 0.76 | — | — | |
| SCHEMBL147493 | 0.74 | TSHR (0.37) | — | |
| SCHEMBL170617 | 0.74 | OPRM1 (0.38) | — | |
| SCHEMBL7125042 | 0.73 | ALDH1A1 (0.35) | — | |
| Ethane SCHEMBL4793720 | 0.73 | ALDH1A1 (0.35) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-58108285-A | — | — | None | — | — | JP | disclosed |
| EP-3159015-A1 | METHOD FOR CLEANING AND DISINFECTING OF DRINKING WATER CONTAINERS | Witty GmbH & Co. KG (DE) | 2017-04-26 | — | — | EP | disclosed |
| EP-2493949-B1 | NON-CRYSTALLISING BIS-OXAZOLIDINES | SIKA TECHNOLOGY AG (CH) | 2016-03-16 | — | — | EP | disclosed |
| US-20150148449-A1 | Polyurethane-based Waterproofing Composition for the Water-proofing of Concrete Structures | VERIFI LLC | 2015-05-28 | — | — | US | disclosed |
| EP-2858965-A1 | POLYURETHANE-BASED WATERPROOFING COMPOSITION FOR THE WATER-PROOFING OF CONCRETE STRUCTURES | W.R. Grace & CO. - CONN. (US) | 2015-04-15 | — | — | EP | disclosed |
| WO-2013182234-A1 | POLYURETHANE-BASED WATERPROOFING COMPOSITION FOR THE WATER-PROOFING OF CONCRETE STRUCTURES | W.R. GRACE & CO.-CONN. (US) | 2013-12-12 | — | — | WO | disclosed |
| EP-2493949-A1 | NON-CRYSTALLISING BIS-OXAZOLIDINES | Sika Technology AG (CH) | 2012-09-05 | — | — | EP | disclosed |
| WO-2011051191-A1 | NON-CRYSTALLISING BIS-OXAZOLIDINES | SIKA TECHNOLOGY AG (CH) | 2011-05-05 | — | — | WO | disclosed |
| US-6703172-B2 | Pellicle and producing method of mask with pellicle | MITSUI CHEMICALS, INC. (JP) | 2004-03-09 | — | — | US | disclosed |
| US-20030096178-A1 | Pellicle and producing method of mask with pellicle | MITSUI CHEMICALS, INC. (JP) | 2003-05-22 | — | — | US | disclosed |
| JP-S58108285-A | ANTISTATIC AGENT | NIPPON STEEL CHEM CO LTD | 1983-06-28 | — | — | JP | disclosed |