⚠ 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 | |
|---|---|---|---|---|
| Propane SCHEMBL5168547 | 0.91 | — | — | |
| Propane SCHEMBL10956924 | 0.89 | TSHR (0.43) | — | |
| Propane SCHEMBL9246294 | 0.89 | — | — | |
| Propane SCHEMBL286506 | 0.89 | — | — | |
| Propane SCHEMBL9248656 | 0.89 | TSHR (0.43) | — | |
| Propane SCHEMBL1021 | 0.89 | — | — | |
| Propane SCHEMBL9719556 | 0.80 | — | — | |
| Propane SCHEMBL5383086 | 0.80 | — | — | |
| Propane SCHEMBL11076973 | 0.80 | — | — | |
| Propane SCHEMBL4449197 | 0.80 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106397963-A | Expanded halogen-free flame-retardant EVA-based composite material and preparation method thereof | 南京理工大学 | 2017-02-15 | — | — | CN | disclosed |
| US-9366788-B2 | Heat radiation reflective film and method for producing the same, and heat radiation reflector | Konica Minolta, Inc. (JP) | 2016-06-14 | — | — | US | disclosed |
| US-20140002895-A1 | HEAT RADIATION REFLECTIVE FILM AND METHOD FOR PRODUCING THE SAME, AND HEAT RADIATION REFLECTOR | KONICA MINOLTA , INC. (JP) | 2014-01-02 | — | — | US | disclosed |
| CN-101778885-B | Curable compositions composed of silanes with two hydrolyzable groups | HENKEL AG & CO KGAA | 2013-07-10 | — | — | CN | disclosed |
| CN-101778885-A | Curable compositions composed of silanes with two hydrolyzable groups | HENKEL AG & CO KGAA | 2010-07-14 | — | — | CN | disclosed |
| US-6365234-B1 | Polymerizable, chromium-free, organic coatings for metal | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2002-04-02 | — | — | US | disclosed |