⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11369602 | 0.83 | — | — | |
| SCHEMBL194332 | 0.77 | — | — | |
| SCHEMBL11376595 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL10622871 | 0.74 | — | — | |
| SCHEMBL8967348 | 0.72 | — | — | |
| SCHEMBL27682076 | 0.72 | — | — | |
| SCHEMBL28807100 | 0.72 | — | — | |
| SCHEMBL9804918 | 0.72 | — | — | |
| Isopropyl Alcohol SCHEMBL28865710 | 0.69 | ALDH1A1 (0.38) | — | |
| SCHEMBL3816588 | 0.67 | — | — |
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-104530417-B | A kind of multiple functionalized H types polyethyleneglycol derivative and preparation method thereof | 厦门赛诺邦格生物科技股份有限公司 | 2017-09-08 | — | — | CN | claimed |
| CN-105732729-A | Bifunctional heteronuclear metal complex or macromolecular polymer as well as preparation method and application thereof | 中国科学院兰州化学物理研究所 | 2016-07-06 | — | — | CN | claimed |
| CN-104530417-A | Multifunctional H-type polyethylene glycol derivative and preparation method thereof | XIAMEN SINOPEG BIOTECH INC | 2015-04-22 | — | — | CN | claimed |
| CN-104530417-B | A kind of multiple functionalized H types polyethyleneglycol derivative and preparation method thereof | 厦门赛诺邦格生物科技股份有限公司 | 2017-09-08 | — | — | CN | disclosed |
| CN-105732729-A | Bifunctional heteronuclear metal complex or macromolecular polymer as well as preparation method and application thereof | 中国科学院兰州化学物理研究所 | 2016-07-06 | — | — | CN | disclosed |
| CN-104530417-A | Multifunctional H-type polyethylene glycol derivative and preparation method thereof | XIAMEN SINOPEG BIOTECH INC | 2015-04-22 | — | — | CN | disclosed |