⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16859 | 0.89 | — | — | |
| SCHEMBL5483305 | 0.89 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL11329859 | 0.80 | — | — | |
| Bromide SCHEMBL3883769 | 0.80 | ALDH1A1 (0.30) | — | |
| SCHEMBL6995610 | 0.80 | — | — | |
| Methane SCHEMBL16428422 | 0.80 | — | — | |
| SCHEMBL538884 | 0.80 | — | — | |
| Bromide SCHEMBL3883770 | 0.80 | — | — | |
| Bromide SCHEMBL538883 | 0.80 | — | — | |
| Fluoride SCHEMBL27965159 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108191828-A | A kind of synthetic method of lenalidomide metabolin | 梯尔希（南京）药物研发有限公司 | 2018-06-22 | — | — | CN | claimed |
| CN-105348112-A | Technological synthesis method of 1-amino cyclopropyl acetylene | HAOYUAN CHEMEXPRESS CO LTD | 2016-02-24 | — | — | CN | claimed |
| CN-108191828-A | A kind of synthetic method of lenalidomide metabolin | 梯尔希（南京）药物研发有限公司 | 2018-06-22 | — | — | CN | disclosed |
| CN-106661065-A | Crystal of cyclic phosphonic acid sodium salt and method for producing same | 大塚化学株式会社 | 2017-05-10 | — | — | CN | disclosed |
| CN-105348112-A | Technological synthesis method of 1-amino cyclopropyl acetylene | HAOYUAN CHEMEXPRESS CO LTD | 2016-02-24 | — | — | CN | disclosed |