⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL28495542 | 0.79 | — | — | |
| SCHEMBL1683193 | 0.75 | — | — | |
| SCHEMBL27691157 | 0.73 | — | — | |
| SCHEMBL28309765 | 0.72 | CRBN (0.38) | — | |
| SCHEMBL13410473 | 0.71 | KDM4E (0.43) | — | |
| SCHEMBL11949176 | 0.70 | CA4 (0.47) | — | |
| SCHEMBL23069338 | 0.69 | CES2 (0.43) | — | |
| SCHEMBL27365311 | 0.67 | — | — | |
| Water SCHEMBL27890637 | 0.67 | — | — | |
| SCHEMBL25512040 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110256883-A | A kind of aqueous UV woodware high-gloss clear finish and preparation method and implementing process | 广东美涂士建材股份有限公司 | 2019-09-20 | — | — | CN | claimed |
| CN-106046385-B | PH responds chitosan gene vector and its preparation method and application | 大连民族大学 | 2018-12-14 | — | — | CN | disclosed |
| CN-106046385-A | pH-response chitosan gene carrier as well as preparation method and application thereof | 大连民族大学 | 2016-10-26 | — | — | CN | disclosed |