⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27627472 | 0.84 | FAAH (0.44) | — | |
| SCHEMBL2363697 | 0.84 | FAAH (0.44) | — | |
| SCHEMBL2363865 | 0.82 | ALDH1A1 (0.42) | — | |
| SCHEMBL2360061 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL28130618 | 0.72 | FAAH (0.32) | — | |
| SCHEMBL11452464 | 0.72 | TDP1 (0.30) | — | |
| 1,6-Hexanediol SCHEMBL9293754 | 0.71 | CNR1 (0.37) | — | |
| SCHEMBL11142801 | 0.70 | — | — | |
| SCHEMBL28346686 | 0.70 | USP2 (0.38) | — | |
| SCHEMBL4252224 | 0.69 | — | — |
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-104114485-B | Mixture of aluminium hydrogen phosphite and aluminium salt, its preparation method and use | 科莱恩金融(BVI)有限公司 | 2018-02-16 | — | — | CN | disclosed |
| CN-104114484-B | Alkali metal-aluminium-mixed phosphites, method for the production thereof and use thereof | 科莱恩金融(BVI)有限公司 | 2017-09-08 | — | — | CN | disclosed |
| CN-104364305-B | Comprise the flame-retardant mixture of fire retardant and aluminium phosphite, Its Preparation Method And Use | 科莱恩金融(BVI)有限公司 | 2016-10-26 | — | — | CN | disclosed |