⚠ 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 | |
|---|---|---|---|---|
| Butanone SCHEMBL27501575 | 0.84 | — | — | |
| Acrylonitrile SCHEMBL10809788 | 0.84 | TDP1 (0.53) | — | |
| Propionamide SCHEMBL28041391 | 0.82 | — | — | |
| Acrylonitrile SCHEMBL2119792 | 0.81 | ALDH1A1 (0.39) | — | |
| Acrylonitrile SCHEMBL28248586 | 0.80 | ALDH1A1 (0.56) | — | |
| Propionic Acid SCHEMBL27554989 | 0.80 | — | — | |
| Acrylonitrile SCHEMBL388549 | 0.80 | — | — | |
| Acrylic Acid SCHEMBL22158721 | 0.80 | LMNA (0.48) | — | |
| Acrylonitrile SCHEMBL180053 | 0.80 | — | — | |
| Propionic Acid SCHEMBL27484067 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106909027-A | Photosensitive composition, colour filter and its preparation method, image display device | 东友精细化工有限公司 | 2017-06-30 | — | — | CN | disclosed |
| CN-104271694-B | Sheet having adhesive resin layer attached thereto, and method for producing semiconductor device | 琳得科株式会社 | 2017-03-22 | — | — | CN | disclosed |
| CN-106019837-A | Colored photosensitive resin composition, color filter, and image display device provided with same | 东友精细化工有限公司 | 2016-10-12 | — | — | CN | disclosed |