⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9725676 | 0.76 | — | — | |
| SCHEMBL20810319 | 0.70 | — | — | |
| SCHEMBL35509 | 0.69 | — | — | |
| SCHEMBL432483 | 0.69 | — | — | |
| SCHEMBL374192 | 0.69 | — | — | |
| SCHEMBL11636127 | 0.69 | SMN1; SMN2 (0.40) | — | |
| SCHEMBL22769625 | 0.68 | SMN1; SMN2 (0.64) | — | |
| SCHEMBL22769626 | 0.68 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL7571311 | 0.68 | SMN1; SMN2 (0.50) | — | |
| SCHEMBL17506144 | 0.68 | CA1 (0.56) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2611842-A1 | INTERLAYER FOR ELECTRONIC DEVICES | Merck Patent GmbH (DE) | 2013-07-10 | — | — | EP | disclosed |
| WO-2012028278-A1 | INTERLAYER FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2012-03-08 | — | — | WO | disclosed |
| US-3970619-A | Polymeric hydroxylated polyesterethers and polyurethane flexible foam prepared therefrom | EASTMAN KODAK COMPANY (US) | 1976-07-20 | — | — | US | disclosed |