⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7106204 | 0.96 | — | — | |
| SCHEMBL9278094 | 0.96 | — | — | |
| SCHEMBL5667722 | 0.87 | — | — | |
| 1,4-Butanediol SCHEMBL30932429 | 0.76 | — | — | |
| SCHEMBL707236 | 0.76 | — | — | |
| 1,4-Butanediol SCHEMBL15086 | 0.76 | — | — | |
| 1,4-Butanediol SCHEMBL18642519 | 0.76 | SMN1; SMN2 (0.58) | — | |
| 1,4-Butanediol SCHEMBL324322 | 0.76 | SMN1; SMN2 (0.58) | — | |
| 1,4-Butanediol SCHEMBL18642509 | 0.76 | SMN1; SMN2 (0.58) | — | |
| SCHEMBL25302278 | 0.71 | TSHR (0.61) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106206083-B | A kind of preparation method of the carbon-based nitridation electrode material of capacitor | 重庆工商大学 | 2018-04-06 | — | — | CN | disclosed |
| US-20170022223-A1 | METHOD FOR PRODUCING SURFACE-MODIFIED BASE MATERIAL, METHOD FOR PRODUCING JOINED BODY, NEW HYDROSILANE COMPOUND, SURFACE TREATMENT AGENT, SURFACE TREATMENT AGENT KIT, AND SURFACE-MODIFIED BASE MATERIAL | SIHS REACT CO., LTD. (JP) | 2017-01-26 | — | — | US | disclosed |
| CN-106206083-A | A kind of preparation method of capacitor carbon back nitridation electrode material | 陆胜 | 2016-12-07 | — | — | CN | disclosed |
| CN-101688042-B | Silicone hydrogel compound for soft contact lenses and soft contact lenses made using the same | BESCON CO LTD | 2012-01-11 | — | — | CN | disclosed |
| CN-101688042-A | Silicone hydrogel compound for soft contact lenses and soft contact lenses made using the same | BESCON CO LTD | 2010-03-31 | — | — | CN | disclosed |
| US-20020096121-A1 | Particulate matter fertilizer composition | PROGENY BIOLOGICAL SYSTEMS, LLC | 2002-07-25 | — | — | US | disclosed |
| US-20020081230-A1 | Method for treatment of animal waste | INNOVATIVE MATERIAL SOLUTIONS, LLC (US) | 2002-06-27 | — | — | US | disclosed |
| US-20020073928-A1 | Floatable porosive particulate matter for treatment of animal waste | INNOVATIVE MATERIAL SOLUTIONS, LLC | 2002-06-20 | — | — | US | disclosed |
| US-20020076360-A1 | System for treatment of animal waste | INNOVATIVE MATERIAL SOLUTIONS, LLC | 2002-06-20 | — | — | US | disclosed |
| US-4154891-A | POLYMERIC POLYOL, AMINE-ALDEHYDE CONDENSATE | PPG INDUSTRIES, INC. (US) | 1979-05-15 | — | — | US | disclosed |