⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28353409 | 0.79 | — | — | |
| SCHEMBL1048637 | 0.70 | — | — | |
| SCHEMBL1758154 | 0.67 | — | — | |
| SCHEMBL9686766 | 0.66 | CYP2C19 (0.30) | — | |
| SCHEMBL912631 | 0.63 | — | — | |
| SCHEMBL29138619 | 0.63 | — | — | |
| SCHEMBL29138616 | 0.63 | — | — | |
| SCHEMBL285205 | 0.62 | — | — | |
| SCHEMBL27811340 | 0.60 | — | — | |
| Ammonia Solution, Strong SCHEMBL7106957 | 0.60 | — | — |
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-110423351-A | A kind of Vinyl MQ silicon resin and preparation method thereof | ZHONGKE GUANGHUA CHONGQING NEW MATERIAL RES INSTITUTE CO LTD | 2019-11-08 | — | — | CN | disclosed |
| CN-107413078-A | Defoamer of Organic fluoride modified silicon oil and preparation method thereof | 苏州博纳化学科技有限公司 | 2017-12-01 | — | — | CN | disclosed |
| CN-107216457-A | Defoamer of fluorine richness organosilicon and preparation method thereof | 苏州博纳化学科技有限公司 | 2017-09-29 | — | — | CN | disclosed |
| CN-107115695-A | Defoamer of fluorine richness silicone oil and preparation method thereof | 苏州博纳化学科技有限公司 | 2017-09-01 | — | — | CN | disclosed |
| CN-107090084-A | Defoamer of polyethers scion grafting polysiloxanes and preparation method thereof | 苏州博纳化学科技有限公司 | 2017-08-25 | — | — | CN | disclosed |
| CN-106977728-A | Makrolon graft copolymer and preparation method thereof | 广州辰东新材料有限公司 | 2017-07-25 | — | — | CN | disclosed |