⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL190975 | 1.00 | — | — | |
| SCHEMBL5605487 | 0.94 | — | — | |
| SCHEMBL8585266 | 0.84 | ARG1 (0.30) | — | |
| SCHEMBL6026639 | 0.81 | ALDH1A1 (0.35) | — | |
| SCHEMBL45919 | 0.80 | — | — | |
| SCHEMBL4556774 | 0.78 | — | — | |
| SCHEMBL4983187 | 0.75 | ALDH1A1 (0.40) | — | |
| SCHEMBL364192 | 0.75 | ALDH1A1 (0.40) | — | |
| SCHEMBL10581419 | 0.74 | — | — | |
| SCHEMBL4662086 | 0.74 | — | — |
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-108699208-A | Curable urethaneacrylates composition with bimodal molecular weight distribution | 陶氏环球技术有限责任公司 | 2018-10-23 | — | — | CN | disclosed |
| CN-108291020-A | Include the adhesive composition and its application of epoxide and the prepolymer with alkoxysilyl | 赢创德固赛有限公司 | 2018-07-17 | — | — | CN | disclosed |
| CN-104185906-B | UV radiation-curable polyurethane resins are used to prepare the purposes of solar energy layer laminate | 科思创德国股份有限公司 | 2018-05-22 | — | — | CN | disclosed |